Chembase list of 866358 unique molecular structures

methyl 5-carbamothioylpyridine-2-carboxylate

$$$$ Data

M. F.

C8H8N2O2S

Suppliers	Catalog Number
Enamine	EN300-90090

Database	Data ID
PubChem	50989119

M. W.

196.22632

CAS

Similarity

N/A

ID: 282552

5-carbamothioylpyridine-2-carboxamide

$$$$ Data

M. F.

C7H7N3OS

Suppliers	Catalog Number
Enamine	EN300-90091

Database	Data ID
PubChem	50989584

M. W.

181.21498

CAS

Similarity

N/A

ID: 282553

[6-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-3-yl]methanamine

$$$$ Data

M. F.

C9H10N4O

Suppliers	Catalog Number
Enamine	EN300-90092

Database	Data ID
PubChem	50987767

M. W.

190.2019

CAS

Similarity

N/A

ID: 282554

methyl 3-iodo-1H-indole-5-carboxylate

$$$$ Data

M. F.

C10H8INO2

Suppliers	Catalog Number
Enamine	EN300-90094

Database	Data ID
PubChem	50989132

M. W.

301.08049

CAS

Similarity

N/A

ID: 282555

3-iodo-1H-indole-5-carboxamide

$$$$ Data

M. F.

C9H7IN2O

Suppliers	Catalog Number
Enamine	EN300-90095

Database	Data ID
PubChem	50989586

M. W.

286.06915

CAS

Similarity

N/A

ID: 282556

methyl 3-(2-chloroacetyl)-1H-indole-5-carboxylate

$$$$ Data

M. F.

C12H10ClNO3

Suppliers	Catalog Number
Enamine	EN300-90096

Database	Data ID
PubChem	15729287

M. W.

251.6657

CAS

Similarity

N/A

ID: 282557

methyl 3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole-5-carboxylate

$$$$ Data

M. F.

C15H16N2O2

Suppliers	Catalog Number
Enamine	EN300-90098

Database	Data ID
PubChem	21469433

M. W.

256.29974

CAS

Similarity

N/A

ID: 282558

3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole-5-carboxamide

$$$$ Data

M. F.

C14H15N3O

Suppliers	Catalog Number
Enamine	EN300-90099

Database	Data ID
PubChem	12042434

M. W.

241.2884

CAS

Similarity

N/A

ID: 282559

methyl 3-(piperidin-4-yl)-1H-indole-5-carboxylate

$$$$ Data

M. F.

C15H18N2O2

Suppliers	Catalog Number
Enamine	EN300-90100

Database	Data ID
PubChem	21469421

M. W.

258.31562

CAS

Similarity

N/A

ID: 282560

3-(piperidin-4-yl)-1H-indole-5-carboxamide

$$$$ Data

M. F.

C14H17N3O

Suppliers	Catalog Number
Enamine	EN300-90101

Database	Data ID
PubChem	21469418

M. W.

243.30428

CAS

Similarity

N/A

ID: 282561

methyl 1-(2-aminoethyl)-1H-indole-5-carboxylate

$$$$ Data

M. F.

C12H14N2O2

Suppliers	Catalog Number
Enamine	EN300-90104

Database	Data ID
PubChem	50989126

M. W.

218.25176

CAS

Similarity

N/A

ID: 282562

methyl 1-(3-aminopropyl)-1H-indole-5-carboxylate

$$$$ Data

M. F.

C13H16N2O2

Suppliers	Catalog Number
Enamine	EN300-90105

Database	Data ID
PubChem	50989125

M. W.

232.27834

CAS

Similarity

N/A

ID: 282563

1-(2-aminoethyl)-1H-indole-5-carboxamide

$$$$ Data

M. F.

C11H13N3O

Suppliers	Catalog Number
Enamine	EN300-90106

Database	Data ID
PubChem	50989774

M. W.

203.24042

CAS

Similarity

N/A

ID: 282564

1-(3-aminopropyl)-1H-indole-5-carboxamide

$$$$ Data

M. F.

C12H15N3O

Suppliers	Catalog Number
Enamine	EN300-90107

Database	Data ID
PubChem	50989769

M. W.

217.267

CAS

Similarity

N/A

ID: 282565

4,5-dichloroquinazoline

$$$$ Data

M. F.

C8H4Cl2N2

Suppliers	Catalog Number
Enamine	EN300-90109
Bide Pharmatech	BD32647
A&J Pharmtech	AJA-O597

Database	Data ID
PubChem	247911

M. W.

199.03676

CAS

2148-55-2

Similarity

N/A

ID: 282566

5-chloro-2-(chloromethyl)-3,4-dihydroquinazolin-4-one

$$$$ Data

M. F.

C9H6Cl2N2O

Suppliers	Catalog Number
Enamine	EN300-90110

Database	Data ID
PubChem	50988921

M. W.

229.06274

CAS

Similarity

N/A

ID: 282567

3-[2-(2,5-dimethylthiophen-3-yl)cyclopent-1-en-1-yl]-2,5-dimethylthiophene

$$$$ Data

M. F.

C17H20S2

Suppliers	Catalog Number
Enamine	EN300-90111

Database	Data ID
PubChem	50987702

M. W.

288.4707

CAS

Similarity

N/A

ID: 282568

5,6-dichloropyridine-3-sulfonamide

$$$$ Data

M. F.

C5H4Cl2N2O2S

Suppliers	Catalog Number
Enamine	EN300-90113

Database	Data ID
PubChem	4730921

M. W.

227.06846

CAS

Similarity

N/A

ID: 282569

6-amino-5-chloropyridine-3-sulfonamide

$$$$ Data

M. F.

C5H6ClN3O2S

Suppliers	Catalog Number
Enamine	EN300-90115

Database	Data ID
PubChem	50989694

M. W.

207.63804

CAS

Similarity

N/A

ID: 282570

5-bromo-6-chloropyridine-3-sulfonamide

$$$$ Data

M. F.

C5H4BrClN2O2S

Suppliers	Catalog Number
Enamine	EN300-90117

Database	Data ID
PubChem	4730022

M. W.

271.51946

CAS

Similarity

N/A

ID: 282571

6-amino-5-bromopyridine-3-sulfonamide

$$$$ Data

M. F.

C5H6BrN3O2S

Suppliers	Catalog Number
Enamine	EN300-90118

Database	Data ID
PubChem	33726134

M. W.

252.08904

CAS

Similarity

N/A

ID: 282572

2,5-difluoro-4-nitroaniline

$$$$ Data

M. F.

C6H4F2N2O2

Suppliers	Catalog Number
Enamine	EN300-90119

Database	Data ID
PubChem	235930

M. W.

174.1049664

CAS

Similarity

N/A

ID: 282573

tert-butyl N-(4-amino-2,5-difluorophenyl)carbamate

$$$$ Data

M. F.

C11H14F2N2O2

Suppliers	Catalog Number
Enamine	EN300-90120

Database	Data ID
PubChem	50986465

M. W.

244.2378664

CAS

Similarity

N/A

ID: 282574

tert-butyl N-(5-amino-2,4-difluorophenyl)carbamate

$$$$ Data

M. F.

C11H14F2N2O2

Suppliers	Catalog Number
Enamine	EN300-90121

Database	Data ID
PubChem	10900857

M. W.

244.2378664

CAS

Similarity

N/A

ID: 282575

6-bromo-2-chloro-7-nitroquinoline

$$$$ Data

M. F.

C9H4BrClN2O2

Suppliers	Catalog Number
Enamine	EN300-90122

Database	Data ID
PubChem	50987290

M. W.

287.49726

CAS

Similarity

N/A

ID: 282576

4-methylcyclohexane-1-sulfonyl chloride

$$$$ Data

M. F.

C7H13ClO2S

Suppliers	Catalog Number
Enamine	EN300-90123

Database	Data ID
PubChem	50987783

M. W.

196.69492

CAS

Similarity

N/A

ID: 282577

4-methylcyclohexane-1-sulfonamide

$$$$ Data

M. F.

C7H15NO2S

Suppliers	Catalog Number
Enamine	EN300-90124

Database	Data ID
PubChem	50987784

M. W.

177.2645

CAS

Similarity

N/A

ID: 282578

3-(trifluoromethyl)oxolan-3-amine

$$$$ Data

M. F.

C5H8F3NO

Suppliers	Catalog Number
Enamine	EN300-90125

Database	Data ID
PubChem	50989636

M. W.

155.1183296

CAS

Similarity

N/A

ID: 282579

3-(trifluoromethyl)oxolan-3-ol

$$$$ Data

M. F.

C5H7F3O2

Suppliers	Catalog Number
Enamine	EN300-90126

Database	Data ID
PubChem	50990625

M. W.

156.1030896

CAS

Similarity

N/A

ID: 282580

2-amino-2-(trifluoromethyl)butanoic acid

$$$$ Data

M. F.

C5H8F3NO2

Suppliers	Catalog Number
Enamine	EN300-90128

Database	Data ID
PubChem	10154236

M. W.

171.1177296

CAS

Similarity

N/A

ID: 282581

2-amino-2-benzyl-3,3,3-trifluoropropanoic acid

$$$$ Data

M. F.

C10H10F3NO2

Suppliers	Catalog Number
Enamine	EN300-90129

Database	Data ID
PubChem	14205532

M. W.

233.1871096

CAS

Similarity

N/A

ID: 282582

(4S)-4-amino-2,2-difluoropentanedioic acid

$$$$ Data

M. F.

C5H7F2NO4

Suppliers	Catalog Number
Enamine	EN300-90133

Database	Data ID
PubChem	125435

M. W.

183.1101864

CAS

Similarity

N/A

ID: 282583

2-(trifluoromethyl)azepane

$$$$ Data

M. F.

C7H12F3N

Suppliers	Catalog Number
Enamine	EN300-90134

Database	Data ID
PubChem	50989379

M. W.

167.1720896

CAS

Similarity

N/A

ID: 282584

2-phenyl-2-(trifluoromethyl)pyrrolidine

$$$$ Data

M. F.

C11H12F3N

Suppliers	Catalog Number
Enamine	EN300-90135

Database	Data ID
PubChem	50989357

M. W.

215.2148896

CAS

Similarity

N/A

ID: 282585

4-methyl-2-(trifluoromethyl)piperidine

$$$$ Data

M. F.

C7H12F3N

Suppliers	Catalog Number
Enamine	EN300-90136

Database	Data ID
PubChem	50987796

M. W.

167.1720896

CAS

Similarity

N/A

ID: 282586

3-(trifluoromethyl)piperazine-1-carbaldehyde

$$$$ Data

M. F.

C6H9F3N2O

Suppliers	Catalog Number
Enamine	EN300-90137

Database	Data ID
PubChem	50989380

M. W.

182.1436696

CAS

Similarity

N/A

ID: 282587

3-(2,2,2-trifluoroethyl)pyrrolidine hydrochloride

$$$$ Data

M. F.

C6H11ClF3N

Suppliers	Catalog Number
Enamine	EN300-90138

Database	Data ID
PubChem	50988606

M. W.

189.6064496

CAS

Similarity

N/A

ID: 282588

3-(trifluoromethyl)oxetan-3-amine

$$$$ Data

M. F.

C4H6F3NO

Suppliers	Catalog Number
Enamine	EN300-90139

Database	Data ID
PubChem	50989639

M. W.

141.0917496

CAS

Similarity

N/A

ID: 282589

3-(trifluoromethyl)azetidin-3-amine

$$$$ Data

M. F.

C4H7F3N2

Suppliers	Catalog Number
Enamine	EN300-90140

Database	Data ID
PubChem	50989638

M. W.

140.1069896

CAS

Similarity

N/A

ID: 282590

4-(trifluoromethyl)oxan-4-amine

$$$$ Data

M. F.

C6H10F3NO

Suppliers	Catalog Number
Enamine	EN300-90141

Database	Data ID
PubChem	50989637

M. W.

169.1449096

CAS

Similarity

N/A

ID: 282591

3-carbamoylcyclohexane-1-carboxylic acid

$$$$ Data

M. F.

C8H13NO3

Suppliers	Catalog Number
Enamine	EN300-90142

Database	Data ID
PubChem	22106836

M. W.

171.19372

CAS

Similarity

N/A

ID: 282592

2-(2-methyl-2,3-dihydro-1,4-benzodioxin-2-yl)ethan-1-amine

$$$$ Data

M. F.

C11H15NO2

Suppliers	Catalog Number
Enamine	EN300-90143

Database	Data ID
PubChem	24252998

M. W.

193.2423

CAS

Similarity

N/A

ID: 282593

(2-methyl-2,3-dihydro-1,4-benzodioxin-2-yl)methanamine

$$$$ Data

M. F.

C10H13NO2

Suppliers	Catalog Number
Enamine	EN300-90144

Database	Data ID
PubChem	14838423

M. W.

179.21572

CAS

Similarity

N/A

ID: 282594

5-benzyl-2-chloro-4,6-dimethylpyrimidine

$$$$ Data

M. F.

C13H13ClN2

Suppliers	Catalog Number
Enamine	EN300-90145

Database	Data ID
PubChem	50987748

M. W.

232.70872

CAS

Similarity

N/A

ID: 282595

5H,6H,7H,8H-imidazo[1,2-a]pyridin-3-amine

$$$$ Data

M. F.

C7H11N3

Suppliers	Catalog Number
ChemBridge	4025666
Enamine	EN300-90147

Database	Data ID
PubChem	28064418

M. W.

137.18234

CAS

1177321-97-9

Similarity

N/A

ID: 282596

5H,6H,7H,8H,9H-imidazo[1,2-a]azepin-3-amine

$$$$ Data

M. F.

C8H13N3

Suppliers	Catalog Number
Enamine	EN300-90148

Database	Data ID
PubChem	50989680

M. W.

151.20892

CAS

Similarity

N/A

ID: 282597

tert-butyl N-(2-phenyl-1,3-thiazol-4-yl)carbamate

$$$$ Data

M. F.

C14H16N2O2S

Suppliers	Catalog Number
Enamine	EN300-90149

Database	Data ID
PubChem	50986470

M. W.

276.35404

CAS

Similarity

N/A

ID: 282598

2,2,2-trifluoroethyl 2-cyanoacetate

$$$$ Data

M. F.

C5H4F3NO2

Suppliers	Catalog Number
Enamine	EN300-90150

Database	Data ID
PubChem	11745010

M. W.

167.0859696

CAS

Similarity

N/A

ID: 282599

bis(2,2,2-trifluoroethyl) oxalate

$$$$ Data

M. F.

C6H4F6O4

Suppliers	Catalog Number
Enamine	EN300-90151

Database	Data ID
PubChem	17759103

M. W.

254.0839792

CAS

Similarity

N/A

ID: 282600

ethyl 2,2,2-trifluoroethyl oxalate

$$$$ Data

M. F.

C6H7F3O4

Suppliers	Catalog Number
Enamine	EN300-90152

Database	Data ID
PubChem	50987987

M. W.

200.1125896

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