Friday, March 29, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-[(3-chlorophenyl)methyl]-2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetamide
CAS Name: N-[(3-chlorophenyl)methyl]-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: N-[(3-chlorophenyl)methyl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: N-[(3-chlorophenyl)methyl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C20H24ClN3O3S
MOLECULAR WEIGHT: 421.94086
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC3=CC(=CC=C3)Cl
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Product OPENEYE NAME: [2-oxo-2-(4-phenylanilino)ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-oxo-2-(4-phenylanilino)ethyl] ester
IUPAC NAME: [2-oxo-2-(4-phenylanilino)ethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-[(4-phenylphenyl)amino]ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C24H19NO4
MOLECULAR WEIGHT: 385.41196
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NC3=CC=C(C=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 1-benzhydryl-1-methyl-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea
CAS Name: 1-(diphenylmethyl)-1-methyl-3-[[(2R)-2-oxolanyl]methyl]thiourea
IUPAC NAME: 1-benzhydryl-1-methyl-3-[[(2R)-oxolan-2-yl]methyl]thiourea
SYSTEMATIC NAME: 1-(diphenylmethyl)-1-methyl-3-[[(2R)-oxolan-2-yl]methyl]thiourea
MOLECULAR FORMULA: C20H24N2OS
MOLECULAR WEIGHT: 340.48236
SMILES: CN(C(C1=CC=CC=C1)C2=CC=CC=C2)C(=S)NC[C@H]3CCCO3
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Product OPENEYE NAME: [(1S)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 4-(4-ethoxyphenyl)-4-oxo-butanoate
CAS Name: 4-(4-ethoxyphenyl)-4-oxobutanoic acid [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] 4-(4-ethoxyphenyl)-4-oxobutanoate
SYSTEMATIC NAME: [(2S)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 4-(4-ethoxyphenyl)-4-oxidanylidene-butanoate
MOLECULAR FORMULA: C23H27NO6
MOLECULAR WEIGHT: 413.46358
SMILES: CCOC1=CC=C(C=C1)C(=O)CCC(=O)O[C@@H](C)C(=O)C2=C(C(=C(N2)C)C(=O)C)C
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Product OPENEYE NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]acetamide
CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide
IUPAC NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
SYSTEMATIC NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C21H32N3O3S+
MOLECULAR WEIGHT: 406.56208
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCCC3=CCCCC3
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Product OPENEYE NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetamide
CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C21H31N3O3S
MOLECULAR WEIGHT: 405.55414
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCCC3=CCCCC3
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Product OPENEYE NAME: 4-fluoro-N-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]-3-nitro-benzamide
CAS Name: 4-fluoro-3-nitro-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide
IUPAC NAME: 4-fluoro-3-nitro-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide
SYSTEMATIC NAME: 4-fluoranyl-3-nitro-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]benzamide
MOLECULAR FORMULA: C13H16FN3O4
MOLECULAR WEIGHT: 297.282243
SMILES: CCCNC(=O)[C@H](C)NC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-]
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Product OPENEYE NAME: [2-(dibenzofuran-2-ylamino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(2-dibenzofuranylamino)-2-oxoethyl] ester
IUPAC NAME: [2-(dibenzofuran-2-ylamino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(dibenzofuran-2-ylamino)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C24H17NO5
MOLECULAR WEIGHT: 399.39548
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NC3=CC4=C(C=C3)OC5=CC=CC=C54
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Product OPENEYE NAME: 2-phenyl-4-[[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]methyl]thiazole
CAS Name: 4-[[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-phenylthiazole
IUPAC NAME: 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-phenyl-1,3-thiazole
SYSTEMATIC NAME: 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-phenyl-1,3-thiazole
MOLECULAR FORMULA: C21H24N3O2S2+
MOLECULAR WEIGHT: 414.56416
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CSC(=N3)C4=CC=CC=C4
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Product OPENEYE NAME: 2-phenyl-4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]thiazole
CAS Name: 4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-2-phenylthiazole
IUPAC NAME: 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-2-phenyl-1,3-thiazole
SYSTEMATIC NAME: 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-2-phenyl-1,3-thiazole
MOLECULAR FORMULA: C21H23N3O2S2
MOLECULAR WEIGHT: 413.55622
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CSC(=N3)C4=CC=CC=C4
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