Thursday, November 1, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 4-(2,2-dimethylchroman-6-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
CAS Name: 4-(2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
IUPAC NAME: 4-(2,2-dimethyl-3,4-dihydrochromen-6-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
SYSTEMATIC NAME: 4-(2,2-dimethyl-3,4-dihydrochromen-6-yl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
MOLECULAR FORMULA: C22H24N2O2
MOLECULAR WEIGHT: 348.43816
SMILES: CC1=C(C(C2=C(N1)CCCC2=O)C3=CC4=C(C=C3)OC(CC4)(C)C)C#N
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Product OPENEYE NAME: methyl 4-[2-chloro-4-(dimethylamino)phenyl]-7-(4-fluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
CAS Name: 4-[2-chloro-4-(dimethylamino)phenyl]-7-(4-fluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester
IUPAC NAME: methyl 4-[2-chloro-4-(dimethylamino)phenyl]-7-(4-fluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SYSTEMATIC NAME: methyl 4-[2-chloranyl-4-(dimethylamino)phenyl]-7-(4-fluorophenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
MOLECULAR FORMULA: C26H26ClFN2O3
MOLECULAR WEIGHT: 468.947643
SMILES: CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)F)C4=C(C=C(C=C4)N(C)C)Cl)C(=O)OC
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Product OPENEYE NAME: 4-(3-methoxycarbonyl-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-4-yl)benzoic acid
CAS Name: 4-(3-methoxycarbonyl-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-4-yl)benzoic acid
IUPAC NAME: 4-(3-methoxycarbonyl-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-4-yl)benzoic acid
SYSTEMATIC NAME: 4-(3-methoxycarbonyl-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinolin-4-yl)benzoic acid
MOLECULAR FORMULA: C19H19NO5
MOLECULAR WEIGHT: 341.35786
SMILES: CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)C(=O)O)C(=O)OC
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Product OPENEYE NAME: methyl 2-methyl-5-oxo-4-(1H-pyrazol-4-yl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
CAS Name: 2-methyl-5-oxo-4-(1H-pyrazol-4-yl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester
IUPAC NAME: methyl 2-methyl-5-oxo-4-(1H-pyrazol-4-yl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SYSTEMATIC NAME: methyl 2-methyl-5-oxidanylidene-4-(1H-pyrazol-4-yl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
MOLECULAR FORMULA: C15H17N3O3
MOLECULAR WEIGHT: 287.31378
SMILES: CC1=C(C(C2=C(N1)CCCC2=O)C3=CNN=C3)C(=O)OC
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Product OPENEYE NAME: methyl 2-methyl-5-oxo-4-[5-(2-thienyl)-2-thienyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
CAS Name: 2-methyl-5-oxo-4-(5-thiophen-2-yl-2-thiophenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester
IUPAC NAME: methyl 2-methyl-5-oxo-4-(5-thiophen-2-ylthiophen-2-yl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SYSTEMATIC NAME: methyl 2-methyl-5-oxidanylidene-4-(5-thiophen-2-ylthiophen-2-yl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
MOLECULAR FORMULA: C20H19NO3S2
MOLECULAR WEIGHT: 385.49976
SMILES: CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(S3)C4=CC=CS4)C(=O)OC
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Product OPENEYE NAME: methyl 4-(2,3-dihydrobenzofuran-6-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
CAS Name: 4-(2,3-dihydrobenzofuran-6-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester
IUPAC NAME: methyl 4-(2,3-dihydro-1-benzofuran-6-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SYSTEMATIC NAME: methyl 4-(2,3-dihydro-1-benzofuran-6-yl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
MOLECULAR FORMULA: C20H21NO4
MOLECULAR WEIGHT: 339.38504
SMILES: CC1=C(C(C2=C(N1)CCCC2=O)C3=CC4=C(CCO4)C=C3)C(=O)OC
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Product OPENEYE NAME: methyl 4-(4-benzyloxy-3-methoxy-phenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
CAS Name: 4-(3-methoxy-4-phenylmethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester
IUPAC NAME: methyl 4-(3-methoxy-4-phenylmethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SYSTEMATIC NAME: methyl 4-(3-methoxy-4-phenylmethoxy-phenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
MOLECULAR FORMULA: C26H27NO5
MOLECULAR WEIGHT: 433.49628
SMILES: CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)OC
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Product OPENEYE NAME: methyl 4-(2,2-dimethylchroman-6-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
CAS Name: 4-(2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester
IUPAC NAME: methyl 4-(2,2-dimethyl-3,4-dihydrochromen-6-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SYSTEMATIC NAME: methyl 4-(2,2-dimethyl-3,4-dihydrochromen-6-yl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
MOLECULAR FORMULA: C23H27NO4
MOLECULAR WEIGHT: 381.46478
SMILES: CC1=C(C(C2=C(N1)CCCC2=O)C3=CC4=C(C=C3)OC(CC4)(C)C)C(=O)OC
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Product OPENEYE NAME: 1-(4-benzyloxyphenyl)-3-(2,5-diphenylpyrazol-3-yl)urea
CAS Name: 1-(2,5-diphenyl-3-pyrazolyl)-3-(4-phenylmethoxyphenyl)urea
IUPAC NAME: 1-(2,5-diphenylpyrazol-3-yl)-3-(4-phenylmethoxyphenyl)urea
SYSTEMATIC NAME: 1-(2,5-diphenylpyrazol-3-yl)-3-(4-phenylmethoxyphenyl)urea
MOLECULAR FORMULA: C29H24N4O2
MOLECULAR WEIGHT: 460.52646
SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)NC3=CC(=NN3C4=CC=CC=C4)C5=CC=CC=C5
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Product OPENEYE NAME: 1-(1,3-diphenylpyrazol-4-yl)-3-(p-tolylsulfonyl)urea
CAS Name: 1-(1,3-diphenyl-4-pyrazolyl)-3-(4-methylphenyl)sulfonylurea
IUPAC NAME: 1-(1,3-diphenylpyrazol-4-yl)-3-(4-methylphenyl)sulfonylurea
SYSTEMATIC NAME: 1-(1,3-diphenylpyrazol-4-yl)-3-(4-methylphenyl)sulfonyl-urea
MOLECULAR FORMULA: C23H20N4O3S
MOLECULAR WEIGHT: 432.4949
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 1-(2,4-difluorophenyl)-3-(1,3-diphenylpyrazol-4-yl)urea
CAS Name: 1-(2,4-difluorophenyl)-3-(1,3-diphenyl-4-pyrazolyl)urea
IUPAC NAME: 1-(2,4-difluorophenyl)-3-(1,3-diphenylpyrazol-4-yl)urea
SYSTEMATIC NAME: 1-[2,4-bis(fluoranyl)phenyl]-3-(1,3-diphenylpyrazol-4-yl)urea
MOLECULAR FORMULA: C22H16F2N4O
MOLECULAR WEIGHT: 390.385446
SMILES: C1=CC=C(C=C1)C2=NN(C=C2NC(=O)NC3=C(C=C(C=C3)F)F)C4=CC=CC=C4
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Product OPENEYE NAME: benzyl 4-[(4-sulfamoylanilino)carbamoyl]piperidine-1-carboxylate
CAS Name: 4-[oxo-[(4-sulfamoylphenyl)hydrazo]methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester
IUPAC NAME: benzyl 4-[(4-sulfamoylanilino)carbamoyl]piperidine-1-carboxylate
SYSTEMATIC NAME: (phenylmethyl) 4-[[(4-sulfamoylphenyl)amino]carbamoyl]piperidine-1-carboxylate
MOLECULAR FORMULA: C20H24N4O5S
MOLECULAR WEIGHT: 432.49336
SMILES: C1CN(CCC1C(=O)NNC2=CC=C(C=C2)S(=O)(=O)N)C(=O)OCC3=CC=CC=C3
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Product OPENEYE NAME: benzyl 4-[(2,4-difluorophenyl)carbamoyl]piperidine-1-carboxylate
CAS Name: 4-[(2,4-difluoroanilino)-oxomethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester
IUPAC NAME: benzyl 4-[(2,4-difluorophenyl)carbamoyl]piperidine-1-carboxylate
SYSTEMATIC NAME: (phenylmethyl) 4-[[2,4-bis(fluoranyl)phenyl]carbamoyl]piperidine-1-carboxylate
MOLECULAR FORMULA: C20H20F2N2O3
MOLECULAR WEIGHT: 374.381206
SMILES: C1CN(CCC1C(=O)NC2=C(C=C(C=C2)F)F)C(=O)OCC3=CC=CC=C3
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Product OPENEYE NAME: benzyl 4-(1,3-benzodioxol-5-ylmethylcarbamoyl)piperidine-1-carboxylate
CAS Name: 4-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester
IUPAC NAME: benzyl 4-(1,3-benzodioxol-5-ylmethylcarbamoyl)piperidine-1-carboxylate
SYSTEMATIC NAME: (phenylmethyl) 4-(1,3-benzodioxol-5-ylmethylcarbamoyl)piperidine-1-carboxylate
MOLECULAR FORMULA: C22H24N2O5
MOLECULAR WEIGHT: 396.43636
SMILES: C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)OCC4=CC=CC=C4
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Product OPENEYE NAME: benzyl 4-[(4-morpholinophenyl)carbamoyl]piperidine-1-carboxylate
CAS Name: 4-[[4-(4-morpholinyl)anilino]-oxomethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester
IUPAC NAME: benzyl 4-[(4-morpholin-4-ylphenyl)carbamoyl]piperidine-1-carboxylate
SYSTEMATIC NAME: (phenylmethyl) 4-[(4-morpholin-4-ylphenyl)carbamoyl]piperidine-1-carboxylate
MOLECULAR FORMULA: C24H29N3O4
MOLECULAR WEIGHT: 423.50476
SMILES: C1CN(CCC1C(=O)NC2=CC=C(C=C2)N3CCOCC3)C(=O)OCC4=CC=CC=C4
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Product OPENEYE NAME: (2-morpholinophenyl) thiophene-2-carboxylate
CAS Name: 2-thiophenecarboxylic acid [2-(4-morpholinyl)phenyl] ester
IUPAC NAME: (2-morpholin-4-ylphenyl) thiophene-2-carboxylate
SYSTEMATIC NAME: (2-morpholin-4-ylphenyl) thiophene-2-carboxylate
MOLECULAR FORMULA: C15H15NO3S
MOLECULAR WEIGHT: 289.3495
SMILES: C1COCCN1C2=CC=CC=C2OC(=O)C3=CC=CS3
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Product OPENEYE NAME: (2-morpholinophenyl) 2-methyl-6-(trifluoromethyl)pyridine-3-carboxylate
CAS Name: 2-methyl-6-(trifluoromethyl)-3-pyridinecarboxylic acid [2-(4-morpholinyl)phenyl] ester
IUPAC NAME: (2-morpholin-4-ylphenyl) 2-methyl-6-(trifluoromethyl)pyridine-3-carboxylate
SYSTEMATIC NAME: (2-morpholin-4-ylphenyl) 2-methyl-6-(trifluoromethyl)pyridine-3-carboxylate
MOLECULAR FORMULA: C18H17F3N2O3
MOLECULAR WEIGHT: 366.33439
SMILES: CC1=C(C=CC(=N1)C(F)(F)F)C(=O)OC2=CC=CC=C2N3CCOCC3
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Product OPENEYE NAME: (2-morpholinophenyl) 3,5-bis(methylsulfanyl)isothiazole-4-carboxylate
CAS Name: 3,5-bis(methylthio)-4-isothiazolecarboxylic acid [2-(4-morpholinyl)phenyl] ester
IUPAC NAME: (2-morpholin-4-ylphenyl) 3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxylate
SYSTEMATIC NAME: (2-morpholin-4-ylphenyl) 3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxylate
MOLECULAR FORMULA: C16H18N2O3S3
MOLECULAR WEIGHT: 382.52072
SMILES: CSC1=C(C(=NS1)SC)C(=O)OC2=CC=CC=C2N3CCOCC3
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
MOLECULAR FORMULA: C17H15NO5
MOLECULAR WEIGHT: 313.3047
SMILES: C1C(OC2=CC=CC=C2O1)C(=O)NCC3=CC4=C(C=C3)OCO4
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-6-(trifluoromethyl)-3-pyridinecarboxamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
MOLECULAR FORMULA: C16H13F3N2O3
MOLECULAR WEIGHT: 338.28123
SMILES: CC1=C(C=CC(=N1)C(F)(F)F)C(=O)NCC2=CC3=C(C=C2)OCO3
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-3,5-bis(methylsulfanyl)isothiazole-4-carboxamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3,5-bis(methylthio)-4-isothiazolecarboxamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxamide
MOLECULAR FORMULA: C14H14N2O3S3
MOLECULAR WEIGHT: 354.46756
SMILES: CSC1=C(C(=NS1)SC)C(=O)NCC2=CC3=C(C=C2)OCO3
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