Chembase list of 866358 unique molecular structures

2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)-N-phenylacetamide

$$$$ Data

M. F.

C16H15N3O2

Suppliers	Catalog Number
Enamine	EN300-06253

Database	Data ID
PubChem	2829724

M. W.

281.3092

CAS

36932-40-8

Similarity

N/A

ID: 232102

3-(2-sulfanyl-1H-1,3-benzodiazol-1-yl)propanenitrile

$$$$ Data

M. F.

C10H9N3S

Suppliers	Catalog Number
Enamine	EN300-06254

Database	Data ID
PubChem	2809686

M. W.

203.26356

CAS

Similarity

N/A

ID: 232103

N-(4-ethoxyphenyl)-2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetamide

$$$$ Data

M. F.

C18H19N3O3

Suppliers	Catalog Number
Enamine	EN300-06255

Database	Data ID
PubChem	2865575

M. W.

325.36176

CAS

40375-94-8

Similarity

N/A

ID: 232104

3-ethoxy-4-(2-phenoxyethoxy)benzoic acid

$$$$ Data

M. F.

C17H18O5

Suppliers	Catalog Number
Enamine	EN300-06256

Database	Data ID
PubChem	2433229

M. W.

302.32182

CAS

Similarity

N/A

ID: 232105

5-butyl-5-phenylimidazolidine-2,4-dione

$$$$ Data

M. F.

C13H16N2O2

Suppliers	Catalog Number
Enamine	EN300-06258

Database	Data ID
PubChem	3868221

M. W.

232.27834

CAS

Similarity

N/A

ID: 232106

2-amino-N-(4-chloro-2-methoxy-5-methylphenyl)benzamide

$$$$ Data

M. F.

C15H15ClN2O2

Suppliers	Catalog Number
Enamine	EN300-06260

Database	Data ID
PubChem	2435426

M. W.

290.7448

CAS

Similarity

N/A

ID: 232107

N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2-chloroacetamido)benzamide

$$$$ Data

M. F.

C17H16Cl2N2O3

Suppliers	Catalog Number
Enamine	EN300-06261

Database	Data ID
PubChem	2435433

M. W.

367.22654

CAS

Similarity

N/A

ID: 232108

2-amino-N-(3-methoxyphenyl)benzamide

$$$$ Data

M. F.

C14H14N2O2

Suppliers	Catalog Number
ChemBridge	6081882
Enamine	EN300-06262

Database	Data ID
PubChem	2442203

M. W.

242.27316

CAS

74699-52-8

Similarity

N/A

ID: 232109

5-[(4-benzylpiperidin-1-yl)sulfonyl]-2-chloropyridine

$$$$ Data

M. F.

C17H19ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-06263

Database	Data ID
PubChem	2433232

M. W.

350.86296

CAS

Similarity

N/A

ID: 232110

4-[(6-chloropyridin-3-yl)sulfonyl]morpholine

$$$$ Data

M. F.

C9H11ClN2O3S

Suppliers	Catalog Number
Enamine	EN300-06264

Database	Data ID
PubChem	274147

M. W.

262.71324

CAS

52480-33-8

Similarity

N/A

ID: 232111

2-chloro-5-(piperidine-1-sulfonyl)pyridine

$$$$ Data

M. F.

C10H13ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-06265

Database	Data ID
PubChem	2433201

M. W.

260.74042

CAS

64614-52-4

Similarity

N/A

ID: 232112

2-chloro-5-(pyrrolidine-1-sulfonyl)pyridine

$$$$ Data

M. F.

C9H11ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-06266

Database	Data ID
PubChem	2433223

M. W.

246.71384

CAS

64614-51-3

Similarity

N/A

ID: 232113

1-[(6-chloropyridin-3-yl)sulfonyl]-4-methylpiperazine

$$$$ Data

M. F.

C10H14ClN3O2S

Suppliers	Catalog Number
Enamine	EN300-06267

Database	Data ID
PubChem	822457

M. W.

275.75506

CAS

64614-53-5

Similarity

N/A

ID: 232114

N,N-dibenzyl-6-chloropyridine-3-sulfonamide

$$$$ Data

M. F.

C19H17ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-06268

Database	Data ID
PubChem	2433225

M. W.

372.86848

CAS

Similarity

N/A

ID: 232115

6-chloro-N,N-diethylpyridine-3-sulfonamide

$$$$ Data

M. F.

C9H13ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-06269

Database	Data ID
PubChem	2433226

M. W.

248.72972

CAS

54864-87-8

Similarity

N/A

ID: 232116

2,3-dihydro-1H-perimidine-2-thione

$$$$ Data

M. F.

C11H8N2S

Suppliers	Catalog Number
Enamine	EN300-06270

Database	Data ID
PubChem	723643

M. W.

200.25962

CAS

30837-62-8

Similarity

N/A

ID: 232117

6-chloro-N-ethyl-N-phenylpyridine-3-sulfonamide

$$$$ Data

M. F.

C13H13ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-06271

Database	Data ID
PubChem	2433221

M. W.

296.77252

CAS

Similarity

N/A

ID: 232118

6-chloro-N,N-bis(propan-2-yl)pyridine-3-sulfonamide

$$$$ Data

M. F.

C11H17ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-06272

Database	Data ID
PubChem	2433231

M. W.

276.78288

CAS

Similarity

N/A

ID: 232119

3-(2,3-dihydro-1,4-benzodioxine-6-sulfonamido)benzoic acid

$$$$ Data

M. F.

C15H13NO6S

Suppliers	Catalog Number
Enamine	EN300-06273

Database	Data ID
PubChem	1226543

M. W.

335.33182

CAS

Similarity

N/A

ID: 232120

4-{[(2-chlorophenyl)methyl]amino}-3-nitrobenzoic acid

$$$$ Data

M. F.

C14H11ClN2O4

Suppliers	Catalog Number
Enamine	EN300-06274

Database	Data ID
PubChem	3862074

M. W.

306.70114

CAS

Similarity

N/A

ID: 232121

1H,2H,3H,4H-benzo[h]quinolin-3-ol

$$$$ Data

M. F.

C13H13NO

Suppliers	Catalog Number
Enamine	EN300-06275

Database	Data ID
PubChem	95477

M. W.

199.24842

CAS

5423-67-6

Similarity

N/A

ID: 232122

ethyl 3-oxo-4-(1,1,3-trioxo-2,3-dihydro-1λ⁶,2-benzothiazol-2-yl)buta...

$$$$ Data

M. F.

C13H13NO6S

Suppliers	Catalog Number
Enamine	EN300-06276

Database	Data ID
PubChem	2394013

M. W.

311.31042

CAS

Similarity

N/A

ID: 232123

ethyl 2-[(2Z)-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-1,3-thiazolidin-2-ylidene]...

$$$$ Data

M. F.

C13H18N2O5S

Suppliers	Catalog Number
Enamine	EN300-06278

Database	Data ID
PubChem	2435432

M. W.

314.35742

CAS

Similarity

N/A

ID: 232124

4-[(E)-2-phenylethenesulfonamido]benzoic acid

$$$$ Data

M. F.

C15H13NO4S

Suppliers	Catalog Number
Enamine	EN300-06281

Database	Data ID
PubChem	765496

M. W.

303.33302

CAS

Similarity

N/A

ID: 232125

2-[2-(3,4-dimethylbenzenesulfonamido)acetamido]acetic acid

$$$$ Data

M. F.

C12H16N2O5S

Suppliers	Catalog Number
Enamine	EN300-06282

Database	Data ID
PubChem	2478625

M. W.

300.33084

CAS

Similarity

N/A

ID: 232126

2-(4-bromo-2-fluorophenoxy)acetic acid

$$$$ Data

M. F.

C8H6BrFO3

Suppliers	Catalog Number
Enamine	EN300-06283

Database	Data ID
PubChem	2437591

M. W.

249.0338432

CAS

451-90-1

Similarity

N/A

ID: 232127

3-amino-1,3-diazaspiro[4.5]decane-2,4-dione

$$$$ Data

M. F.

C8H13N3O2

Suppliers	Catalog Number
Enamine	EN300-06284

Database	Data ID
PubChem	2437589

M. W.

183.20772

CAS

16252-63-4

Similarity

N/A

ID: 232128

ethyl 4-(1H-imidazol-1-yl)-3-nitrobenzoate

$$$$ Data

M. F.

C12H11N3O4

Suppliers	Catalog Number
Enamine	EN300-06285

Database	Data ID
PubChem	3705371

M. W.

261.23344

CAS

Similarity

N/A

ID: 232129

2-[4-chloro-5-methyl-2-(propan-2-yl)phenoxy]acetic acid

$$$$ Data

M. F.

C12H15ClO3

Suppliers	Catalog Number
Enamine	EN300-06286

Database	Data ID
PubChem	223350

M. W.

242.6987

CAS

5411-11-0

Similarity

N/A

ID: 232130

N,N'-bis(4-chlorophenyl)propanediamide

$$$$ Data

M. F.

C15H12Cl2N2O2

Suppliers	Catalog Number
Enamine	EN300-06287

Database	Data ID
PubChem	481668

M. W.

323.17398

CAS

17722-20-2

Similarity

N/A

ID: 232131

3-(phenoxymethyl)-1-benzofuran-2-carboxylic acid

$$$$ Data

M. F.

C16H12O4

Suppliers	Catalog Number
Enamine	EN300-06289

Database	Data ID
PubChem	120004

M. W.

268.26408

CAS

28664-92-8

Similarity

N/A

ID: 232132

3-[(benzylsulfanyl)methyl]-1-benzofuran-2-carboxylic acid

$$$$ Data

M. F.

C17H14O3S

Suppliers	Catalog Number
Enamine	EN300-06290

Database	Data ID
PubChem	2478633

M. W.

298.35626

CAS

Similarity

N/A

ID: 232133

3-[(cyclohexylsulfanyl)methyl]-1-benzofuran-2-carboxylic acid

$$$$ Data

M. F.

C16H18O3S

Suppliers	Catalog Number
Enamine	EN300-06291

Database	Data ID
PubChem	2478636

M. W.

290.37732

CAS

Similarity

N/A

ID: 232134

3-{[(4-chlorophenyl)sulfanyl]methyl}-1-benzofuran-2-carboxylic acid

$$$$ Data

M. F.

C16H11ClO3S

Suppliers	Catalog Number
Enamine	EN300-06292

Database	Data ID
PubChem	2478639

M. W.

318.77474

CAS

Similarity

N/A

ID: 232135

3-[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-3-oxopropanenitrile

$$$$ Data

M. F.

C15H13ClN2O

Suppliers	Catalog Number
Enamine	EN300-06293

Database	Data ID
PubChem	2478622

M. W.

272.72952

CAS

Similarity

N/A

ID: 232136

methyl 2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-2-yl}acetate

$$$$ Data

M. F.

C11H12N2O3S

Suppliers	Catalog Number
Enamine	EN300-06294

Database	Data ID
PubChem	2393687

M. W.

252.28958

CAS

105219-75-8

Similarity

N/A

ID: 232137

2-hydroxy-9,10-dihydroacridin-9-one

$$$$ Data

M. F.

C13H9NO2

Suppliers	Catalog Number
Enamine	EN300-06295

Database	Data ID
PubChem	436659

M. W.

211.21606

CAS

7466-73-1

Similarity

N/A

ID: 232138

3-amino-4-methyl-N-(3-methylphenyl)benzene-1-sulfonamide

$$$$ Data

M. F.

C14H16N2O2S

Suppliers	Catalog Number
Enamine	EN300-06296

Database	Data ID
PubChem	3777319

M. W.

276.35404

CAS

Similarity

N/A

ID: 232139

3-[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-3-oxopropanenitrile

$$$$ Data

M. F.

C17H18N2O

Suppliers	Catalog Number
Enamine	EN300-06298

Database	Data ID
PubChem	2437447

M. W.

266.33762

CAS

Similarity

N/A

ID: 232140

N-(2-chloroacetyl)-4-(dimethylsulfamoyl)benzamide

$$$$ Data

M. F.

C11H13ClN2O4S

Suppliers	Catalog Number
Enamine	EN300-06300

Database	Data ID
PubChem	2437450

M. W.

304.74992

CAS

Similarity

N/A

ID: 232141

2-amino-N-phenylbenzene-1-sulfonamide

$$$$ Data

M. F.

C12H12N2O2S

Suppliers	Catalog Number
Enamine	EN300-06301

Database	Data ID
PubChem	291711

M. W.

248.30088

CAS

27332-20-3

Similarity

N/A

ID: 232142

(2E)-3-(4-butoxy-3-ethoxyphenyl)prop-2-enoic acid

$$$$ Data

M. F.

C15H20O4

Suppliers	Catalog Number
Enamine	EN300-06302

Database	Data ID
PubChem	2437629

M. W.

264.3169

CAS

Similarity

N/A

ID: 232143

1-(2-propoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione

$$$$ Data

M. F.

C13H13NO3

Suppliers	Catalog Number
Enamine	EN300-06303

Database	Data ID
PubChem	2246135

M. W.

231.24722

CAS

Similarity

N/A

ID: 232144

1-(4-propoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione

$$$$ Data

M. F.

C13H13NO3

Suppliers	Catalog Number
Enamine	EN300-06304

Database	Data ID
PubChem	605191

M. W.

231.24722

CAS

Similarity

N/A

ID: 232145

4-(4-chloro-2-nitrophenoxy)benzaldehyde

$$$$ Data

M. F.

C13H8ClNO4

Suppliers	Catalog Number
Enamine	EN300-06305

Database	Data ID
PubChem	2063244

M. W.

277.65992

CAS

Similarity

N/A

ID: 232146

3-[4-(dimethylamino)phenyl]-2-sulfanylidene-1,3-thiazolidin-4-one

$$$$ Data

M. F.

C11H12N2OS2

Suppliers	Catalog Number
Enamine	EN300-06307

Database	Data ID
PubChem	1321754

M. W.

252.35578

CAS

34557-44-3

Similarity

N/A

ID: 232147

ethyl 2-[(2Z)-3-{[(2,5-dimethylphenyl)carbamoyl]methyl}-4-oxo-1,3-thiazolidin-2-...

$$$$ Data

M. F.

C17H20N2O4S

Suppliers	Catalog Number
Enamine	EN300-06312

Database	Data ID
PubChem	2442168

M. W.

348.4167

CAS

Similarity

N/A

ID: 232148

ethyl 2-[(2Z)-3-{[(2,3-dimethylphenyl)carbamoyl]methyl}-4-oxo-1,3-thiazolidin-2-...

$$$$ Data

M. F.

C17H20N2O4S

Suppliers	Catalog Number
Enamine	EN300-06313

Database	Data ID
PubChem	2435451

M. W.

348.4167

CAS

Similarity

N/A

ID: 232149

ethyl 2-[(2Z)-3-{[(3,4-dichlorophenyl)carbamoyl]methyl}-4-oxo-1,3-thiazolidin-2-...

$$$$ Data

M. F.

C15H14Cl2N2O4S

Suppliers	Catalog Number
Enamine	EN300-06314

Database	Data ID
PubChem	2401375

M. W.

389.25366

CAS

Similarity

N/A

ID: 232150

3-[3-(4-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propanoic acid

$$$$ Data

M. F.

C18H16N2O3

Suppliers	Catalog Number
Enamine	EN300-06315

Database	Data ID
PubChem	2435453

M. W.

308.33124

CAS

84312-87-8

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