Chembase list of 866358 unique molecular structures

3-(1H-1,2,3,4-tetrazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-amine

$$$$ Data

M. F.

C9H11N5S

Suppliers	Catalog Number
Matrix Scientific	063429

Database	Data ID
PubChem	5302410

M. W.

221.28214

CAS

Similarity

N/A

ID: 58252

3,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrazole-4-carbaldehyde

$$$$ Data

M. F.

C9H12N2O

Suppliers	Catalog Number
ChemBridge	4033486
Matrix Scientific	063431

Database	Data ID
PubChem	43647154

M. W.

164.20438

CAS

1155595-91-7

Similarity

N/A

ID: 58253

3-(4-nitrophenyl)-4,5-dihydro-1H-1,2,4-triazole-5-thione

$$$$ Data

M. F.

C8H6N4O2S

Suppliers	Catalog Number
Matrix Scientific	063432
Enamine	EN300-110630

Database	Data ID
PubChem	4325803

M. W.

222.22384

CAS

Similarity

N/A

ID: 58254

3-(4-bromophenyl)-4,5-dihydro-1H-1,2,4-triazole-5-thione

$$$$ Data

M. F.

C8H6BrN3S

Suppliers	Catalog Number
Matrix Scientific	063433

Database	Data ID
PubChem	853332

M. W.

256.12234

CAS

39631-33-9

Similarity

N/A

ID: 58255

3-(3-methoxyphenyl)-4,5-dihydro-1H-1,2,4-triazole-5-thione

$$$$ Data

M. F.

C9H9N3OS

Suppliers	Catalog Number
Matrix Scientific	063434

Database	Data ID
PubChem	12190356

M. W.

207.25226

CAS

419540-45-7

Similarity

N/A

ID: 58256

3-(3-nitrophenyl)-4,5-dihydro-1H-1,2,4-triazole-5-thione

$$$$ Data

M. F.

C8H6N4O2S

Suppliers	Catalog Number
Matrix Scientific	063435

Database	Data ID
PubChem	3111207

M. W.

222.22384

CAS

Similarity

N/A

ID: 58257

N-tert-butylprop-2-enamide

$$$$ Data More

M. F.

C7H13NO

Suppliers	Catalog Number
Sigma Aldrich	411779
MP Biomedicals	05209626
Alfa Aesar	B20394

Database	Data ID
PubChem	7877

M. W.

127.18422

CAS

107-58-4

Similarity

N/A

ID: 58258

1-(3-methylphenyl)pyrrolidin-2-one

$$$$ Data

M. F.

C11H13NO

Suppliers	Catalog Number
Matrix Scientific	063437

Database	Data ID
PubChem	314213

M. W.

175.22702

CAS

Similarity

N/A

ID: 58259

methyl 3-(2-oxopyrrolidin-1-yl)benzoate

$$$$ Data

M. F.

C12H13NO3

Suppliers	Catalog Number
Matrix Scientific	063438

Database	Data ID
PubChem	667806

M. W.

219.23652

CAS

Similarity

N/A

ID: 58260

methyl 4-(2-oxopyrrolidin-1-yl)benzoate

$$$$ Data

M. F.

C12H13NO3

Suppliers	Catalog Number
Matrix Scientific	063439

Database	Data ID
PubChem	757827

M. W.

219.23652

CAS

Similarity

N/A

ID: 58261

4-(2-oxopyrrolidin-1-yl)benzoic acid

$$$$ Data More

M. F.

C11H11NO3

Suppliers	Catalog Number
ChemBridge	4400186
Matrix Scientific	063440
Life Chemicals	F2124-0539

Database	Data ID
PubChem	773130

M. W.

205.20994

CAS

36151-44-7

Similarity

N/A

ID: 58262

1-(4-methylphenyl)pyrrolidin-2-one

$$$$ Data

M. F.

C11H13NO

Suppliers	Catalog Number
Matrix Scientific	063441

Database	Data ID
PubChem	577781

M. W.

175.22702

CAS

3063-79-4

Similarity

N/A

ID: 58263

1-(4-methoxyphenyl)pyrrolidin-2-one

$$$$ Data

M. F.

C11H13NO2

Suppliers	Catalog Number
Matrix Scientific	063442

Database	Data ID
PubChem	121705

M. W.

191.22642

CAS

Similarity

N/A

ID: 58264

1-(4-bromophenyl)pyrrolidin-2-one

$$$$ Data More

M. F.

C10H10BrNO

Suppliers	Catalog Number
Alfa Aesar	H50563
Matrix Scientific	063443
Apollo Scientific	OR9934

Database	Data ID
PubChem	736110

M. W.

240.0965

CAS

7661-32-7

Similarity

N/A

ID: 58265

1-(4-chlorophenyl)pyrrolidin-2-one

$$$$ Data

M. F.

C10H10ClNO

Suppliers	Catalog Number
Matrix Scientific	063444

Database	Data ID
PubChem	2724713

M. W.

195.6455

CAS

7661-33-8

Similarity

N/A

ID: 58266

2-(4,6-dimethyl-3-nitro-2-oxo-1,2-dihydropyridin-1-yl)acetic acid

$$$$ Data

M. F.

C9H10N2O5

Suppliers	Catalog Number
Matrix Scientific	063445
Apollo Scientific	OR13565

Database	Data ID
PubChem	614645

M. W.

226.1861

CAS

Similarity

N/A

ID: 58267

1-(propan-2-yl)pyrrolidine

$$$$ Data

M. F.

C7H15N

Suppliers	Catalog Number
Sigma Aldrich	692603
Matrix Scientific	063446

Database	Data ID
PubChem	12416324

M. W.

113.2007

CAS

17544-07-9

Similarity

N/A

ID: 58268

1-cyclohexylpyrrolidine

$$$$ Data

M. F.

C10H19N

Suppliers	Catalog Number
Matrix Scientific	063447

Database	Data ID
PubChem	139064

M. W.

153.26456

CAS

Similarity

N/A

ID: 58269

3-(3,3-dimethylbutanamido)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylic acid

$$$$ Data

M. F.

C13H16N4O3

Suppliers	Catalog Number
Matrix Scientific	063448

Database	Data ID
PubChem	46318320

M. W.

276.29114

CAS

Similarity

N/A

ID: 58270

1-{[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazine

$$$$ Data

M. F.

C13H15FN4O

Suppliers	Catalog Number
Matrix Scientific	063449

Database	Data ID
PubChem	42656756

M. W.

262.2828032

CAS

Similarity

N/A

ID: 58271

[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl](methyl)amine

$$$$ Data

M. F.

C7H11N3O

Suppliers	Catalog Number
ChemBridge	4014787
Matrix Scientific	063450

Database	Data ID
PubChem	28063999

M. W.

153.18174

CAS

1177299-92-1

Similarity

N/A

ID: 58272

[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methanamine

$$$$ Data

M. F.

C6H11N3O

Suppliers	Catalog Number
ChemBridge	4013194
Matrix Scientific	063451

Database	Data ID
PubChem	17604995

M. W.

141.17104

CAS

Similarity

N/A

ID: 58273

3-nitro-1H-1,2,4-triazole

$$$$ Data More

M. F.

C2H2N4O2

Suppliers	Catalog Number
Sigma Aldrich	N3759 241792 74085
MP Biomedicals	02155931
Alfa Aesar	L06845

Database	Data ID
PubChem	90614

M. W.

114.06288

CAS

24807-55-4

Similarity

N/A

ID: 58274

5-methyl-2H-1,2,3,4-tetrazole

$$$$ Data More

M. F.

C2H4N4

Suppliers	Catalog Number
Sigma Aldrich	535052
Alfa Aesar	H60248
Matrix Scientific	063453

Database	Data ID
PubChem	138107

M. W.

84.07996

CAS

4076-36-2

Similarity

N/A

ID: 58275

5-phenyl-2H-1,2,3,4-tetrazole

$$$$ Data More

M. F.

C7H6N4

Suppliers	Catalog Number
Sigma Aldrich	347744
Alfa Aesar	B25664
Matrix Scientific	063454

Database	Data ID
PubChem	87425

M. W.

146.14934

CAS

18039-42-4

Similarity

N/A

ID: 58276

3,5-dimethyl-4H-1,2,4-triazole

$$$$ Data More

M. F.

C4H7N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00083
ChemBridge	4030190
Matrix Scientific	063455

Database	Data ID
PubChem	139001

M. W.

97.11848

CAS

7343-34-2

Similarity

N/A

ID: 58277

3,5-dichloro-1H-1,2,4-triazole

$$$$ Data

M. F.

C2HCl2N3

Suppliers	Catalog Number
ChemBridge	4040447
Matrix Scientific	063456
InterBioScreen	BB_SC-1578

Database	Data ID
PubChem	98635

M. W.

137.95544

CAS

10327-87-4

Similarity

N/A

ID: 58278

3-(furan-2-yl)-1H-1,2,4-triazole-5-thiol

$$$$ Data

M. F.

C6H5N3OS

Suppliers	Catalog Number
Matrix Scientific	063457
InterBioScreen	BB_SC-5267
Enamine	EN300-25952

Database	Data ID
PubChem	716904

M. W.

167.1884

CAS

35771-65-4

Similarity

N/A

ID: 58279

3-cyclopentyl-1H-1,2,4-triazole-5-thiol

$$$$ Data

M. F.

C7H11N3S

Suppliers	Catalog Number
Matrix Scientific	063458
Enamine	EN300-26343

Database	Data ID
PubChem	1449026

M. W.

169.24734

CAS

Similarity

N/A

ID: 58280

3-cyclopentyl-1H-1,2,4-triazole

$$$$ Data

M. F.

C7H11N3

Suppliers	Catalog Number
ChemBridge	4035864
Matrix Scientific	063459

Database	Data ID
PubChem	19068003

M. W.

137.18234

CAS

1210317-84-2

Similarity

N/A

ID: 58281

5-bromo-3-cyclopentyl-1H-1,2,4-triazole

$$$$ Data

M. F.

C7H10BrN3

Suppliers	Catalog Number
ChemBridge	4036251
Matrix Scientific	063460

Database	Data ID
PubChem	45791280

M. W.

216.0784

CAS

1210976-47-8

Similarity

N/A

ID: 58282

3-(propan-2-yl)-1H-1,2,4-triazole-5-thiol

$$$$ Data

M. F.

C5H9N3S

Suppliers	Catalog Number
Matrix Scientific	063461
Enamine	EN300-06550

Database	Data ID
PubChem	2447514

M. W.

143.21006

CAS

59689-64-4

Similarity

N/A

ID: 58283

3-cyclopropyl-1H-1,2,4-triazole

$$$$ Data

M. F.

C5H7N3

Suppliers	Catalog Number
ChemBridge	4035922
Matrix Scientific	063462

Database	Data ID
PubChem	19608838

M. W.

109.12918

CAS

1211390-33-8

Similarity

N/A

ID: 58284

3-tert-butyl-1H-1,2,4-triazole

$$$$ Data

M. F.

C6H11N3

Suppliers	Catalog Number
ChemBridge	4044776
Matrix Scientific	063463

Database	Data ID
PubChem	15745252

M. W.

125.17164

CAS

96440-78-7

Similarity

N/A

ID: 58285

3-bromo-5-(ethylsulfanyl)-1H-1,2,4-triazole

$$$$ Data

M. F.

C4H6BrN3S

Suppliers	Catalog Number
ChemBridge	4035185
Matrix Scientific	063464

Database	Data ID
PubChem	45791242

M. W.

208.07954

CAS

1209935-35-2

Similarity

N/A

ID: 58286

[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]methanol

$$$$ Data

M. F.

C10H10N2O2

Suppliers	Catalog Number
Matrix Scientific	063465
Apollo Scientific	OR4419

Database	Data ID
PubChem	7060549

M. W.

190.1986

CAS

852180-61-1

Similarity

N/A

ID: 58287

3-methyl-1,2,4-oxadiazol-5-amine

$$$$ Data More

M. F.

C3H5N3O

Suppliers	Catalog Number
ChemBridge	4035358
Matrix Scientific	063466
Enamine	EN300-33308

Database	Data ID
PubChem	567118

M. W.

99.0913

CAS

3663-39-6

Similarity

N/A

ID: 58288

5-(ethylsulfanyl)-1H-1,2,4-triazol-3-amine

$$$$ Data

M. F.

C4H8N4S

Suppliers	Catalog Number
ChemBridge	4028309
Matrix Scientific	063467

Database	Data ID
PubChem	1391503

M. W.

144.19812

CAS

51420-35-0

Similarity

N/A

ID: 58289

3-(propan-2-yl)-1,2,4-oxadiazol-5-amine

$$$$ Data

M. F.

C5H9N3O

Suppliers	Catalog Number
ChemBridge	4035754
Matrix Scientific	063468
Enamine	EN300-78762

Database	Data ID
PubChem	21138953

M. W.

127.14446

CAS

3874-89-3

Similarity

N/A

ID: 58290

3-cyclopropyl-1,2,4-oxadiazol-5-amine

$$$$ Data

M. F.

C5H7N3O

Suppliers	Catalog Number
ChemBridge	4035370
Matrix Scientific	063469
Enamine	EN300-79196

Database	Data ID
PubChem	22661056

M. W.

125.12858

CAS

302842-68-8

Similarity

N/A

ID: 58291

2-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]ethan-1-amine

$$$$ Data

M. F.

C10H11N3S

Suppliers	Catalog Number
ChemBridge	4027631
Matrix Scientific	063470

Database	Data ID
PubChem	18523684

M. W.

205.27944

CAS

938283-17-1

Similarity

N/A

ID: 58292

2-amino-3-(5-methoxy-1H-indol-3-yl)propanoic acid

$$$$ Data

M. F.

C12H14N2O3

Suppliers	Catalog Number
Sigma Aldrich	M4001 65380
MP Biomedicals	02155448
Matrix Scientific	063471

Database	Data ID
PubChem	119802

M. W.

234.25116

CAS

28052-84-8

Similarity

N/A

ID: 58293

4-phenyl-1,3-thiazole-2-carboxylic acid

$$$$ Data

M. F.

C10H7NO2S

Suppliers	Catalog Number
ChemBridge	4401055
Matrix Scientific	063472
A&J Pharmtech	AJA-O40284

Database	Data ID
PubChem	3878539

M. W.

205.23308

CAS

59020-44-9

Similarity

N/A

ID: 58294

2-chloro-2-oxoethyl acetate

$$$$ Data

M. F.

C4H5ClO3

Suppliers	Catalog Number
Sigma Aldrich	302368
Matrix Scientific	063473
Apollo Scientific	OR1899

Database	Data ID
PubChem	26297

M. W.

136.5337

CAS

13831-31-7

Similarity

N/A

ID: 58295

5-methylhexane-2,4-dione

$$$$ Data More

M. F.

C7H12O2

Suppliers	Catalog Number
ChemBridge	4036300
Matrix Scientific	063474
Chemik	CHO0165

Database	Data ID
PubChem	138984

M. W.

128.16898

CAS

7307-03-1

Similarity

N/A

ID: 58296

3-methyl-5-(propan-2-yl)-1H-pyrazole

$$$$ Data

M. F.

C7H12N2

Suppliers	Catalog Number
ChemBridge	4035799
Matrix Scientific	063475

Database	Data ID
PubChem	10844390

M. W.

124.18358

CAS

132558-01-1

Similarity

N/A

ID: 58297

$$$$ Data

M. F.

C14H10S4

Suppliers	Catalog Number
Sigma Aldrich	723118
Matrix Scientific	063476

Database	Data ID
PubChem	10902862

M. W.

306.4892

CAS

5873-93-8

Similarity

N/A

ID: 58298

4-methyl-2-oxo-1,2-dihydroquinoline-3-carbonitrile

$$$$ Data

M. F.

C11H8N2O

Suppliers	Catalog Number
Matrix Scientific	063477

Database	Data ID
PubChem	603563

M. W.

184.19402

CAS

Similarity

N/A

ID: 58299

2-chloro-4-methylquinoline-3-carbonitrile

$$$$ Data More

M. F.

C11H7ClN2

Suppliers	Catalog Number
Matrix Scientific	063478
Maybridge	SPB07728
Apollo Scientific	OR30030

Database	Data ID
PubChem	2800491

M. W.

202.63968

CAS

101617-94-1

Similarity

N/A

ID: 58300

N-(3-aminopropyl)methanesulfonamide

$$$$ Data

M. F.

C4H12N2O2S

Suppliers	Catalog Number
Matrix Scientific	063479
Enamine	EN300-30677

Database	Data ID
PubChem	18350602

M. W.

152.21528

CAS

88334-76-3

Similarity

N/A

Part I: Carbon
- I.1: Carbon-Carbon Bonds
- I.1.1 Alkanes
- Primary carbon
- Secondary carbon
- Tertiary carbon
- Quaternary carbon
- I.1.2 C-C double and Triple Bonds
- Alkene
- Alkyne
- Allene
- I.2: One Carbon-Hetero Bond
- I.2.1 Alkyl Halogenides
- Alkylchloride
- Alkylfluoride
- Alkylbromide
- Alkyliodide
- I.2.2 Alcohols and Ethers
- Alcohol
- Primary alcohol
- Secondary alcohol
- Tertiary alcohol
- Dialkylether
- Dialkylthioether
- Alkylarylether
- Diarylether
- Alkylarylthioether
- Diarylthioether
- Oxonium
- I.2.3 Amines
- Amine
- Primary aliphatic amine
- Secondary aliphatic amine
- Tertiary aliphatic amine
- Quaternary aliphatic ammonium
- Primary aromatic amine
- Secondary aromatic amine
- Tertiary aromatic amine
- Quaternary aromatic ammonium
- Secondary mixed amine
- Tertiary mixed amine
- Quaternary mixed ammonium
- Ammonium
- I.2.4 Others
- Alkylthiol
- Dialkylthioether
- Alkylarylthioether
- Disulfide
- 1,2-Aminoalcohol
- 1,2-Diol
- 1,1-Diol
- Hydroperoxide
- Peroxo
- Organolithium compounds
- Organomagnesium compounds
- Organometallic compounds
- I.3: Two Carbon-Hetero Bonds (Carbonyl and Derivatives)
- I.3.1 Double Bond to Hetero
- Aldehyde
- Ketone
- Thioaldehyde
- Thioketone
- Imine
- Immonium
- Oxime
- Oximether
- I.3.2. Two Single Bonds to Hetero
- Acetal
- Hemiacetal
- Aminal
- Hemiaminal
- Thioacetal
- Thiohemiacetal
- Halogen acetal like
- Acetal like
- Halogenmethylen ester and similar
- NOS methylen ester and similar
- Hetero methylen ester and similar
- Cyanhydrine
- I.3.3 Single Bond to Hetero, C=C Double Bond (Enols and Similar)
- Chloroalkene
- Fluoroalkene
- Bromoalkene
- Iodoalkene
- Enol
- Endiol
- Enolether
- Enolester
- Enamine
- Thioenol
- Thioenolether
- I.4: Three Carbon-Hetero Bonds (Carboxyl and Derivatives)
- Acylchloride
- Acylfluoride
- Acylbromide
- Acyliodide
- Acylhalide
- Carboxylic acid
- Carboxylic ester
- Lactone
- Carboxylic anhydride
- Carboxylic acid derivative
- Carbothioic acid
- Carbothioic S ester
- Carbothioic S lactone
- Carbothioic O ester
- Carbothioic O lactone
- Carbothioic halide
- Carbodithioic acid
- Carbodithioic ester
- Carbodithiolactone
- Amide
- Primary amide
- Secondary amide
- Tertiary amide
- Lactam
- Alkyl imide
- N hetero imide
- Imide acidic
- Thioamide
- Thiolactam
- Oximester
- Amidine
- Hydroxamic acid
- Hydroxamic acid ester
- Imidoacid
- Imidoacid cyclic
- Imidoester
- Imidolactone
- Imidothioacid
- Imidothioacid cyclic
- Imidothioester
- Imidothiolactone
- Amidine
- Imidolactam
- Imidoylhalide
- Imidoylhalide cyclic
- Amidrazone
- Alpha aminoacid
- Alpha hydroxyacid
- Peptide middle
- Peptide C term
- Peptide N term
- Carboxylic orthoester
- Ketene
- Ketenacetal
- Nitrile
- Isonitrile
- Vinylogous carbonyl or carboxyl derivative
- Vinylogous acid
- Vinylogous ester
- Vinylogous amide
- Vinylogous halide
- I.5: Four Carbon-Hetero Bonds (Carbonic Acid and Derivatives)
- Carbonic acid dieester
- Carbonic acid esterhalide
- Carbonic acid monoester
- Carbonic acid derivatives
- Thiocarbonic acid dieester
- Thiocarbonic acid esterhalide
- Thiocarbonic acid monoester
- Urea
- Thiourea
- Isourea
- Isothiourea
- Guanidine
- Carbaminic acid
- Urethan(Carbamate ester)
- Biuret
- Semicarbazide
- Carbazide
- Semicarbazone
- Carbazone
- Thiosemicarbazide
- Thiocarbazide
- Thiosemicarbazone
- Thiocarbazone
- Isocyanate
- Cyanate
- Isothiocyanate
- Thiocyanate
- Carbodiimide
- Orthocarbonic derivatives
- I.6 Aromatics
- Phenol
- 1,2-Diphenol
- Arylchloride
- Arylfluoride
- Arylbromide
- Aryliodide
- Arylthiol
- Iminoarene
- Oxoarene
- Thioarene
- Hetero N basic H
- Hetero N basic no H
- Hetero N nonbasic
- Hetero O
- Hetero S
- Heteroaromatic
Part II: N, S, P, Si, B
- II.1 Nitrogen
- Nitrite
- Thionitrite
- Nitrate
- Nitro
- Nitroso
- Azide
- Acylazide
- Diazo
- Diazonium
- Nitrosamine
- Nitrosamide
- N-Oxide
- Hydrazine
- Hydrazone
- Hydroxylamine
- II.2 Sulfur
- Sulfon
- Sulfoxide
- Sulfonium
- Sulfuric acid
- Sulfuric monoester
- Sulfuric diester
- Sulfuric monoamide
- Sulfuric diamide
- Sulfuric esteramide
- Sulfuric derivative
- Sulfonic acid
- Sulfonamide
- Sulfonic ester
- Sulfonic halide
- Sulfonic derivative
- Sulfinic acid
- Sulfinic amide
- Sulfinic ester
- Sulfinic halide
- Sulfinic derivative
- Sulfenic acid
- Sulfenic amide
- Sulfenic ester
- Sulfenic halide
- Sulfenic derivative
- II.3 Phosphorous
- Phosphine
- Phosphine oxide
- Phosphonium
- Phosphorylen
- Phosphonic acid
- Phosphonic monoester
- Phosphonic diester
- Phosphonic monoamide
- Phosphonic diamide
- Phosphonic esteramide
- Phosphonic acid derivative
- Phosphoric acid
- Phosphoric monoester
- Phosphoric diester
- Phosphoric triester
- Phosphoric monoamide
- Phosphoric diamide
- Phosphoric triamide
- Phosphoric monoestermonoamide
- Phosphoric diestermonoamide
- Phosphoric monoesterdiamide
- Phosphoric acid derivative
- Phosphinic acid
- Phosphinic ester
- Phosphinic amide
- Phosphinic acid derivative
- Phosphonous acid
- Phosphonous monoester
- Phosphonous diester
- Phosphonous monoamide
- Phosphonous diamide
- Phosphonous esteramide
- Phosphonous derivatives
- Phosphinous acid
- Phosphinous ester
- Phosphinous amide
- Phosphinous derivatives
- II.4 Silicon
- Quart silane
- Non-quart silane
- Silylmonohalide
- Het trialkylsilane
- Dihet dialkylsilane
- Trihet alkylsilane
- Silicic acid derivative
- II.5 Boron
- Trialkylborane
- Boric acid derivatives
- Boronic acid derivative
- Borohydride
- Quaternary boron
Part III: Some Special Patterns
- III.1 Chains
- III.2 Rings
- Aromatic
- Heterocyclic
- Epoxide
- NH aziridine
- Spiro
- Annelated rings
- Bridged rings
- III.3 Sugars and Nucleosides/Nucleotides, Steroids
- Sugar pattern 1
- Sugar pattern 2
- Sugar pattern combi
- Sugar pattern 2 reducing
- Sugar pattern 2 alpha
- Sugar pattern 2 beta
- III.4 Everything else...
- Conjugated double bond
- Conjugated tripple bond
- Cis double bond
- Trans double bond
- Mixed anhydrides
- Halogen on hetero
- Halogen multi subst
- Trifluoromethyl
- C ONS bond
- Charged
- Anion
- Kation
- Salt
- 1,3-Tautomerizable
- 1,5-Tautomerizable
- Rotatable bond
- Michael acceptor
- Dicarbodiazene
- CH-acidic
- CH-acidic strong
- Chiral center specified