Chembase list of 866358 unique molecular structures

1-(2,4-dimethoxyphenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C11H12N2O2S

Suppliers	Catalog Number
Life Chemicals	F2147-0393

Database	Data ID
PubChem	33678819

M. W.

236.29018

CAS

Similarity

N/A

ID: 116652

1-[3-(trifluoromethyl)phenyl]-1H-imidazole-2-thiol

$$$$ Data

M. F.

C10H7F3N2S

Suppliers	Catalog Number
Life Chemicals	F2147-0394

Database	Data ID
PubChem	2777651

M. W.

244.2361896

CAS

Similarity

N/A

ID: 116653

1-(chloromethyl)-6,7-dimethoxy-3,4-dihydroisoquinoline

$$$$ Data

M. F.

C12H14ClNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0395

Database	Data ID
PubChem	414797

M. W.

239.69806

CAS

Similarity

N/A

ID: 116654

3-[(4-chlorophenyl)methyl]-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

$$$$ Data

M. F.

C11H8ClN5O

Suppliers	Catalog Number
Life Chemicals	F2147-0399

Database	Data ID
PubChem	6409919

M. W.

261.66712

CAS

Similarity

N/A

ID: 116655

3-[(4-chlorophenyl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine-7-thiol

$$$$ Data

M. F.

C11H8ClN5S

Suppliers	Catalog Number
Life Chemicals	F2147-0400

Database	Data ID
PubChem	6409928

M. W.

277.73272

CAS

Similarity

N/A

ID: 116656

1-(3-fluorophenyl)-5-oxopyrrolidine-3-carbonyl chloride

$$$$ Data

M. F.

C11H9ClFNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0401

Database	Data ID
PubChem	45496496

M. W.

241.6460632

CAS

Similarity

N/A

ID: 116657

1-(3-fluorophenyl)-4-isocyanatopyrrolidin-2-one

$$$$ Data

M. F.

C11H9FN2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0403

Database	Data ID
PubChem	45496497

M. W.

220.1997632

CAS

Similarity

N/A

ID: 116658

4-amino-1-(3-fluorophenyl)pyrrolidin-2-one

$$$$ Data

M. F.

C10H11FN2O

Suppliers	Catalog Number
Life Chemicals	F2147-0404

Database	Data ID
PubChem	20110069

M. W.

194.2055432

CAS

Similarity

N/A

ID: 116659

1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carbonyl chloride

$$$$ Data

M. F.

C13H14ClNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0405

Database	Data ID
PubChem	45496498

M. W.

251.70876

CAS

Similarity

N/A

ID: 116660

1-(3,4-dimethylphenyl)-4-isocyanatopyrrolidin-2-one

$$$$ Data

M. F.

C13H14N2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0407

Database	Data ID
PubChem	45496499

M. W.

230.26246

CAS

Similarity

N/A

ID: 116661

6-amino-5-(2-amino-1-phenylethyl)-1,3-dimethyl-1,2,3,4-tetrahydropyrimidine-2,4-...

$$$$ Data

M. F.

C14H18N4O2

Suppliers	Catalog Number
Life Chemicals	F2147-0409

Database	Data ID
PubChem	45496500

M. W.

274.31832

CAS

Similarity

N/A

ID: 116662

5-amino-1-methyl-1H-1,2,3-triazole-4-carboxamide

$$$$ Data

M. F.

C4H7N5O

Suppliers	Catalog Number
Life Chemicals	F2147-0410

Database	Data ID
PubChem	1499737

M. W.

141.13128

CAS

Similarity

N/A

ID: 116663

3-methyl-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

$$$$ Data

M. F.

C5H5N5O

Suppliers	Catalog Number
Life Chemicals	F2147-0411
Enamine	EN300-100434

Database	Data ID
PubChem	33678848

M. W.

151.1261

CAS

Similarity

N/A

ID: 116664

ethyl 5-(2-chloro-2-oxoacetyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate

$$$$ Data

M. F.

C16H14ClNO4

Suppliers	Catalog Number
Life Chemicals	F2147-0412

Database	Data ID
PubChem	33678849

M. W.

319.73966

CAS

Similarity

N/A

ID: 116665

1-(2H-1,3-benzodioxol-5-ylmethyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C11H10N2O2S

Suppliers	Catalog Number
Life Chemicals	F2147-0415

Database	Data ID
PubChem	33678853

M. W.

234.2743

CAS

Similarity

N/A

ID: 116666

ethyl 2-methyl-4-(thiophen-2-yl)-1H-pyrrole-3-carboxylate

$$$$ Data

M. F.

C12H13NO2S

Suppliers	Catalog Number
Life Chemicals	F2147-0417

Database	Data ID
PubChem	33678855

M. W.

235.30212

CAS

Similarity

N/A

ID: 116667

ethyl 5-(2-chloro-2-oxoacetyl)-2-methyl-4-(thiophen-2-yl)-1H-pyrrole-3-carboxyla...

$$$$ Data

M. F.

C14H12ClNO4S

Suppliers	Catalog Number
Life Chemicals	F2147-0418

Database	Data ID
PubChem	33678859

M. W.

325.76738

CAS

Similarity

N/A

ID: 116668

1,4-dimethoxy-2-[(E)-2-nitroethenyl]benzene

$$$$ Data

M. F.

C10H11NO4

Suppliers	Catalog Number
Sigma Aldrich	639699
Life Chemicals	F2147-0419

Database	Data ID
PubChem	5375912

M. W.

209.19864

CAS

40276-11-7

Similarity

N/A

ID: 116669

ethyl 5-(2-chloro-2-oxoacetyl)-4-(2,5-dimethoxyphenyl)-2-methyl-1H-pyrrole-3-car...

$$$$ Data

M. F.

C18H18ClNO6

Suppliers	Catalog Number
Life Chemicals	F2147-0420

Database	Data ID
PubChem	33678863

M. W.

379.79162

CAS

Similarity

N/A

ID: 116670

1-(3,4-difluorophenyl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine

$$$$ Data

M. F.

C13H12F2N2

Suppliers	Catalog Number
Life Chemicals	F2147-0421

Database	Data ID
PubChem	44116791

M. W.

234.2445864

CAS

Similarity

N/A

ID: 116671

1-(5-methylthiophen-2-yl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine

$$$$ Data

M. F.

C12H14N2S

Suppliers	Catalog Number
Life Chemicals	F2147-0422

Database	Data ID
PubChem	44116792

M. W.

218.31796

CAS

Similarity

N/A

ID: 116672

5-(4-methylbenzenesulfonamido)-1H-1,2,3-triazole-4-carboxamide

$$$$ Data

M. F.

C10H11N5O3S

Suppliers	Catalog Number
Life Chemicals	F2147-0423

Database	Data ID
PubChem	6404013

M. W.

281.29104

CAS

Similarity

N/A

ID: 116673

5-amino-1H-1,2,3-triazole-4-carboxamide

$$$$ Data

M. F.

C3H5N5O

Suppliers	Catalog Number
Life Chemicals	F2147-0424

Database	Data ID
PubChem	225431

M. W.

127.1047

CAS

Similarity

N/A

ID: 116674

3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

$$$$ Data

M. F.

C4H3N5O

Suppliers	Catalog Number
Life Chemicals	F2147-0425
InterBioScreen	STOCK1N-25516

Database	Data ID
PubChem	75895

M. W.

137.09952

CAS

Similarity

N/A

ID: 116675

5-amino-1-ethyl-1H-1,2,3-triazole-4-carboxamide

$$$$ Data

M. F.

C5H9N5O

Suppliers	Catalog Number
Life Chemicals	F2147-0426

Database	Data ID
PubChem	13612142

M. W.

155.15786

CAS

99420-47-0

Similarity

N/A

ID: 116676

3-ethyl-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

$$$$ Data

M. F.

C6H7N5O

Suppliers	Catalog Number
Life Chemicals	F2147-0427

Database	Data ID
PubChem	33678882

M. W.

165.15268

CAS

Similarity

N/A

ID: 116677

1-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine

$$$$ Data

M. F.

C14H14FN7

Suppliers	Catalog Number
Life Chemicals	F2147-0429

Database	Data ID
PubChem	42281812

M. W.

299.3062632

CAS

Similarity

N/A

ID: 116678

1-[3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine

$$$$ Data

M. F.

C15H17N7

Suppliers	Catalog Number
Life Chemicals	F2147-0430

Database	Data ID
PubChem	33678885

M. W.

295.34238

CAS

Similarity

N/A

ID: 116679

1-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine

$$$$ Data

M. F.

C15H17N7O

Suppliers	Catalog Number
Life Chemicals	F2147-0431

Database	Data ID
PubChem	42281810

M. W.

311.34178

CAS

Similarity

N/A

ID: 116680

1-[3-(4-ethoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine

$$$$ Data

M. F.

C16H19N7O

Suppliers	Catalog Number
Life Chemicals	F2147-0432

Database	Data ID
PubChem	33678887

M. W.

325.36836

CAS

Similarity

N/A

ID: 116681

1-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine

$$$$ Data

M. F.

C14H14ClN7

Suppliers	Catalog Number
Life Chemicals	F2147-0433

Database	Data ID
PubChem	42281804

M. W.

315.76086

CAS

Similarity

N/A

ID: 116682

1-[3-(3-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine

$$$$ Data

M. F.

C14H14FN7

Suppliers	Catalog Number
Life Chemicals	F2147-0434

Database	Data ID
PubChem	42281806

M. W.

299.3062632

CAS

Similarity

N/A

ID: 116683

1-{3-phenyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}piperazine

$$$$ Data

M. F.

C14H15N7

Suppliers	Catalog Number
Life Chemicals	F2147-0435

Database	Data ID
PubChem	42281802

M. W.

281.3158

CAS

Similarity

N/A

ID: 116684

1-{3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}piperazine

$$$$ Data

M. F.

C15H17N7

Suppliers	Catalog Number
Life Chemicals	F2147-0436

Database	Data ID
PubChem	42281800

M. W.

295.34238

CAS

Similarity

N/A

ID: 116685

1-[3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine

$$$$ Data

M. F.

C15H17N7O

Suppliers	Catalog Number
Life Chemicals	F2147-0437

Database	Data ID
PubChem	42281808

M. W.

311.34178

CAS

Similarity

N/A

ID: 116686

1-cyclohexyl-1H-imidazole-2-thiol

$$$$ Data

M. F.

C9H14N2S

Suppliers	Catalog Number
Life Chemicals	F2147-0438

Database	Data ID
PubChem	3035127

M. W.

182.28586

CAS

64038-58-0

Similarity

N/A

ID: 116687

1-(oxolan-2-ylmethyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C8H12N2OS

Suppliers	Catalog Number
Life Chemicals	F2147-0439

Database	Data ID
PubChem	43089388

M. W.

184.25868

CAS

Similarity

N/A

ID: 116688

1-[(2-chlorophenyl)methyl]-1H-imidazole-2-thiol

$$$$ Data

M. F.

C10H9ClN2S

Suppliers	Catalog Number
Life Chemicals	F2147-0440

Database	Data ID
PubChem	15124060

M. W.

224.70986

CAS

Similarity

N/A

ID: 116689

1-[(2-methoxyphenyl)methyl]-1H-imidazole-2-thiol

$$$$ Data

M. F.

C11H12N2OS

Suppliers	Catalog Number
Life Chemicals	F2147-0441

Database	Data ID
PubChem	25880076

M. W.

220.29078

CAS

Similarity

N/A

ID: 116690

1-(thiophen-2-ylmethyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C8H8N2S2

Suppliers	Catalog Number
Life Chemicals	F2147-0442

Database	Data ID
PubChem	10198071

M. W.

196.29252

CAS

Similarity

N/A

ID: 116691

1-[(4-chlorophenyl)methyl]-1H-imidazole-2-thiol

$$$$ Data

M. F.

C10H9ClN2S

Suppliers	Catalog Number
Life Chemicals	F2147-0443

Database	Data ID
PubChem	15124062

M. W.

224.70986

CAS

Similarity

N/A

ID: 116692

1-(4-methoxyphenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C10H10N2OS

Suppliers	Catalog Number
Life Chemicals	F2147-0444
Enamine	EN300-12125

Database	Data ID
PubChem	2759656

M. W.

206.2642

CAS

17452-14-1

Similarity

N/A

ID: 116693

1-cyclopentyl-1H-imidazole-2-thiol

$$$$ Data

M. F.

C8H12N2S

Suppliers	Catalog Number
Life Chemicals	F2147-0445

Database	Data ID
PubChem	29062795

M. W.

168.25928

CAS

Similarity

N/A

ID: 116694

6',7'-dimethoxy-1,2,3',4'-tetrahydro-2'H-spiro[indole-3,1'-isoquinoline]-2-one

$$$$ Data

M. F.

C18H18N2O3

Suppliers	Catalog Number
Life Chemicals	F2147-0446

Database	Data ID
PubChem	2999560

M. W.

310.34712

CAS

Similarity

N/A

ID: 116695

1-methyl-5-(4-methylphenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C11H12N2S

Suppliers	Catalog Number
Life Chemicals	F2147-0447
Enamine	EN300-12742

Database	Data ID
PubChem	723537

M. W.

204.29138

CAS

Similarity

N/A

ID: 116696

1-benzyl-5-(4-methylphenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C17H16N2S

Suppliers	Catalog Number
Life Chemicals	F2147-0448

Database	Data ID
PubChem	33678893

M. W.

280.38734

CAS

Similarity

N/A

ID: 116697

5-(4-methylphenyl)-1-phenyl-1H-imidazole-2-thiol

$$$$ Data

M. F.

C16H14N2S

Suppliers	Catalog Number
Life Chemicals	F2147-0449
Enamine	EN300-12860

Database	Data ID
PubChem	4962103

M. W.

266.36076

CAS

Similarity

N/A

ID: 116698

1,5-bis(4-methylphenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C17H16N2S

Suppliers	Catalog Number
Life Chemicals	F2147-0450

Database	Data ID
PubChem	33678897

M. W.

280.38734

CAS

Similarity

N/A

ID: 116699

1-(3-chlorophenyl)-5-(4-methylphenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C16H13ClN2S

Suppliers	Catalog Number
Life Chemicals	F2147-0451

Database	Data ID
PubChem	33678900

M. W.

300.80582

CAS

Similarity

N/A

ID: 116700

1-(4-chlorophenyl)-5-(4-methylphenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C16H13ClN2S

Suppliers	Catalog Number
Life Chemicals	F2147-0452

Database	Data ID
PubChem	33678903

M. W.

300.80582

CAS

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