Monday, January 23, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2,5-dichloro-N-[2-[2-[(4-methoxyphenyl)methylene]hydrazino]-2-oxo-ethyl]benzamide
CAS Name: 2,5-dichloro-N-[2-[2-[(4-methoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide
IUPAC NAME: 2,5-dichloro-N-[2-[2-[(4-methoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide
SYSTEMATIC NAME: 2,5-bis(chloranyl)-N-[2-[2-[(4-methoxyphenyl)methylidene]hydrazinyl]-2-oxidanylidene-ethyl]benzamide
MOLECULAR FORMULA: C17H15Cl2N3O3
MOLECULAR WEIGHT: 380.2253
SMILES: COC1=CC=C(C=C1)C=NNC(=O)CNC(=O)C2=C(C=CC(=C2)Cl)Cl
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Product OPENEYE NAME: 4-benzoyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamothioyl)benzamide
CAS Name: 4-benzoyl-N-[sulfanylidene-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)methyl]benzamide
IUPAC NAME: 4-benzoyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamothioyl)benzamide
SYSTEMATIC NAME: 4-(phenylcarbonyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamothioyl)benzamide
MOLECULAR FORMULA: C22H19N3O2S2
MOLECULAR WEIGHT: 421.53516
SMILES: C1CCC2=C(C1)N=C(S2)NC(=S)NC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4
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Product OPENEYE NAME: N-[5-[2-(4,5-dihydrothiazol-2-ylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide
CAS Name: N-[5-[[2-(4,5-dihydrothiazol-2-ylamino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide
IUPAC NAME: N-[5-[2-(4,5-dihydro-1,3-thiazol-2-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide
SYSTEMATIC NAME: N-[5-[2-(4,5-dihydro-1,3-thiazol-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide
MOLECULAR FORMULA: C15H12F3N5O2S3
MOLECULAR WEIGHT: 447.47829
SMILES: C1CSC(=N1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=CC=C3C(F)(F)F
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Product OPENEYE NAME: N-[[4-(4-ethoxyphenyl)-5-[2-[3-(4-fluorophenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3,5-dimethoxy-benzamide
CAS Name: N-[[4-(4-ethoxyphenyl)-5-[[2-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]thio]-1,2,4-triazol-3-yl]methyl]-3,5-dimethoxybenzamide
IUPAC NAME: N-[[4-(4-ethoxyphenyl)-5-[2-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3,5-dimethoxybenzamide
SYSTEMATIC NAME: N-[[4-(4-ethoxyphenyl)-5-[2-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3,5-dimethoxy-benzamide
MOLECULAR FORMULA: C35H33FN6O5S2
MOLECULAR WEIGHT: 700.802123
SMILES: CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N3C(CC(=N3)C4=CC=CS4)C5=CC=C(C=C5)F)CNC(=O)C6=CC(=CC(=C6)OC)OC
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Product OPENEYE NAME: diethyl 5-[[2-[[4-(2,5-dimethylphenyl)-5-[[(4-methoxybenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate
CAS Name: 5-[[2-[[4-(2,5-dimethylphenyl)-5-[[[(4-methoxyphenyl)-oxomethyl]amino]methyl]-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester
IUPAC NAME: diethyl 5-[[2-[[4-(2,5-dimethylphenyl)-5-[[(4-methoxybenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-methylthiophene-2,4-dicarboxylate
SYSTEMATIC NAME: diethyl 5-[2-[[4-(2,5-dimethylphenyl)-5-[[(4-methoxyphenyl)carbonylamino]methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate
MOLECULAR FORMULA: C32H35N5O7S2
MOLECULAR WEIGHT: 665.7796
SMILES: CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CSC2=NN=C(N2C3=C(C=CC(=C3)C)C)CNC(=O)C4=CC=C(C=C4)OC
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Product OPENEYE NAME: 3-phenyl-1-(p-tolyl)-5,6,7,8-tetrahydro-2H-imidazo[1,2-a]pyridin-4-ium-3-ol
CAS Name: 1-(4-methylphenyl)-3-phenyl-5,6,7,8-tetrahydro-2H-imidazo[1,2-a]pyridin-4-ium-3-ol
IUPAC NAME: 1-(4-methylphenyl)-3-phenyl-5,6,7,8-tetrahydro-2H-imidazo[1,2-a]pyridin-4-ium-3-ol
SYSTEMATIC NAME: 1-(4-methylphenyl)-3-phenyl-5,6,7,8-tetrahydro-2H-imidazo[1,2-a]pyridin-4-ium-3-ol
MOLECULAR FORMULA: C20H23N2O+
MOLECULAR WEIGHT: 307.40942
SMILES: CC1=CC=C(C=C1)N2CC([N+]3=C2CCCC3)(C4=CC=CC=C4)O
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Product OPENEYE NAME: 1-(2,5-dibromophenyl)sulfonyl-3,5-dimethyl-pyrazole
CAS Name: 1-(2,5-dibromophenyl)sulfonyl-3,5-dimethylpyrazole
IUPAC NAME: 1-(2,5-dibromophenyl)sulfonyl-3,5-dimethylpyrazole
SYSTEMATIC NAME: 1-[2,5-bis(bromanyl)phenyl]sulfonyl-3,5-dimethyl-pyrazole
MOLECULAR FORMULA: C11H10Br2N2O2S
MOLECULAR WEIGHT: 394.0823
SMILES: CC1=CC(=NN1S(=O)(=O)C2=C(C=CC(=C2)Br)Br)C
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Product OPENEYE NAME: 2-(3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-ethyl-N-(m-tolyl)acetamide
CAS Name: 2-[(3-cyclohexyl-4-oxo-2-quinazolinyl)thio]-N-ethyl-N-(3-methylphenyl)acetamide
IUPAC NAME: 2-(3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanyl-N-ethyl-N-(3-methylphenyl)acetamide
SYSTEMATIC NAME: 2-(3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-ethyl-N-(3-methylphenyl)ethanamide
MOLECULAR FORMULA: C25H29N3O2S
MOLECULAR WEIGHT: 435.58166
SMILES: CCN(C1=CC=CC(=C1)C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCCC4
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Product OPENEYE NAME: 2-(3,4-dimethoxy-2,6-dinitro-phenyl)acetonitrile
CAS Name: 2-(3,4-dimethoxy-2,6-dinitrophenyl)acetonitrile
IUPAC NAME: 2-(3,4-dimethoxy-2,6-dinitrophenyl)acetonitrile
SYSTEMATIC NAME: 2-(3,4-dimethoxy-2,6-dinitro-phenyl)ethanenitrile
MOLECULAR FORMULA: C10H9N3O6
MOLECULAR WEIGHT: 267.19496
SMILES: COC1=C(C(=C(C(=C1)[N+](=O)[O-])CC#N)[N+](=O)[O-])OC
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Product OPENEYE NAME: 3-[5-(4-chlorophenyl)-2-furyl]-2-[4-(2,4-dichlorophenyl)thiazol-2-yl]prop-2-enenitrile
CAS Name: 3-[5-(4-chlorophenyl)-2-furanyl]-2-[4-(2,4-dichlorophenyl)-2-thiazolyl]-2-propenenitrile
IUPAC NAME: 3-[5-(4-chlorophenyl)furan-2-yl]-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
SYSTEMATIC NAME: 3-[5-(4-chlorophenyl)furan-2-yl]-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
MOLECULAR FORMULA: C22H11Cl3N2OS
MOLECULAR WEIGHT: 457.75954
SMILES: C1=CC(=CC=C1C2=CC=C(O2)C=C(C#N)C3=NC(=CS3)C4=C(C=C(C=C4)Cl)Cl)Cl
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Product OPENEYE NAME: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]cyclooctanone oxime
CAS Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-cyclooctanone oxime
IUPAC NAME: N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]cyclooctylidene]hydroxylamine
SYSTEMATIC NAME: N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]cyclooctylidene]hydroxylamine
MOLECULAR FORMULA: C11H18N4OS
MOLECULAR WEIGHT: 254.35182
SMILES: CN1C=NN=C1SC2CCCCCCC2=NO
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Product OPENEYE NAME: 3,9-dibromo-6-butyl-2-hydroxy-pyrano[3,2-c]quinoline-4,5-dione
CAS Name: 3,9-dibromo-6-butyl-2-hydroxypyrano[3,2-c]quinoline-4,5-dione
IUPAC NAME: 3,9-dibromo-6-butyl-2-hydroxypyrano[3,2-c]quinoline-4,5-dione
SYSTEMATIC NAME: 3,9-bis(bromanyl)-6-butyl-2-oxidanyl-pyrano[3,2-c]quinoline-4,5-dione
MOLECULAR FORMULA: C16H13Br2NO4
MOLECULAR WEIGHT: 443.08672
SMILES: CCCCN1C2=C(C=C(C=C2)Br)C3=C(C1=O)C(=O)C(=C(O3)O)Br
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Product OPENEYE NAME: N1,N2-bis(undeca-2,4-diynyl)benzene-1,2-diamine
CAS Name: N1,N2-bis(undeca-2,4-diynyl)benzene-1,2-diamine
IUPAC NAME: 1-N,2-N-bis(undeca-2,4-diynyl)benzene-1,2-diamine
SYSTEMATIC NAME: N1,N2-bis(undeca-2,4-diynyl)benzene-1,2-diamine
MOLECULAR FORMULA: C28H36N2
MOLECULAR WEIGHT: 400.59884
SMILES: CCCCCCC#CC#CCNC1=CC=CC=C1NCC#CC#CCCCCCC
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Product OPENEYE NAME: N-(1-diethoxyphosphoryl-2,2,2-trifluoro-ethyl)-4-fluoro-benzamide
CAS Name: N-(1-diethoxyphosphoryl-2,2,2-trifluoroethyl)-4-fluorobenzamide
IUPAC NAME: N-(1-diethoxyphosphoryl-2,2,2-trifluoroethyl)-4-fluorobenzamide
SYSTEMATIC NAME: N-[1-diethoxyphosphoryl-2,2,2-tris(fluoranyl)ethyl]-4-fluoranyl-benzamide
MOLECULAR FORMULA: C13H16F4NO4P
MOLECULAR WEIGHT: 357.237814
SMILES: CCOP(=O)(C(C(F)(F)F)NC(=O)C1=CC=C(C=C1)F)OCC
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Product OPENEYE NAME: 3,3-bis(benzylsulfanyl)-2-diethoxyphosphoryl-prop-2-enenitrile
CAS Name: 2-diethoxyphosphoryl-3,3-bis(phenylmethylthio)-2-propenenitrile
IUPAC NAME: 3,3-bis(benzylsulfanyl)-2-diethoxyphosphorylprop-2-enenitrile
SYSTEMATIC NAME: 2-diethoxyphosphoryl-3,3-bis(phenylmethylsulfanyl)prop-2-enenitrile
MOLECULAR FORMULA: C21H24NO3PS2
MOLECULAR WEIGHT: 433.523921
SMILES: CCOP(=O)(C(=C(SCC1=CC=CC=C1)SCC2=CC=CC=C2)C#N)OCC
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Product OPENEYE NAME: 2-(2-phenylbenzimidazol-1-yl)cyclooctanone oxime
CAS Name: 2-(2-phenyl-1-benzimidazolyl)-1-cyclooctanone oxime
IUPAC NAME: N-[2-(2-phenylbenzimidazol-1-yl)cyclooctylidene]hydroxylamine
SYSTEMATIC NAME: N-[2-(2-phenylbenzimidazol-1-yl)cyclooctylidene]hydroxylamine
MOLECULAR FORMULA: C21H23N3O
MOLECULAR WEIGHT: 333.42682
SMILES: C1CCCC(=NO)C(CC1)N2C3=CC=CC=C3N=C2C4=CC=CC=C4
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