Tuesday, April 2, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-(3-chlorophenyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
CAS Name: N-(3-chlorophenyl)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide
IUPAC NAME: N-(3-chlorophenyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
SYSTEMATIC NAME: N-(3-chlorophenyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C20H25ClN3O3S+
MOLECULAR WEIGHT: 422.9488
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)Cl
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Product OPENEYE NAME: N-(3-chlorophenyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
CAS Name: N-(3-chlorophenyl)-2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: N-(3-chlorophenyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(3-chlorophenyl)-2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C20H24ClN3O3S
MOLECULAR WEIGHT: 421.94086
SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC(=CC=C3)Cl
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Product OPENEYE NAME: (2S,3R)-N-(4-fluorophenyl)-3-methyl-2-phenyl-pentanamide
CAS Name: (2S,3R)-N-(4-fluorophenyl)-3-methyl-2-phenylpentanamide
IUPAC NAME: (2S,3R)-N-(4-fluorophenyl)-3-methyl-2-phenylpentanamide
SYSTEMATIC NAME: (2S,3R)-N-(4-fluorophenyl)-3-methyl-2-phenyl-pentanamide
MOLECULAR FORMULA: C18H20FNO
MOLECULAR WEIGHT: 285.355903
SMILES: CC[C@@H](C)[C@@H](C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)F
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Product OPENEYE NAME: [(1R)-2-(4-fluoroanilino)-2-oxo-1-phenyl-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(1R)-2-(4-fluoroanilino)-2-oxo-1-phenylethyl] ester
IUPAC NAME: [(1R)-2-(4-fluoroanilino)-2-oxo-1-phenylethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(1R)-2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C24H18FNO4
MOLECULAR WEIGHT: 403.402423
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)O[C@H](C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F
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Product OPENEYE NAME: (E)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide
CAS Name: (E)-N-[2-[(2-fluorophenyl)methylthio]ethyl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-2-propenamide
IUPAC NAME: (E)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide
SYSTEMATIC NAME: (E)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide
MOLECULAR FORMULA: C21H22FNO4S
MOLECULAR WEIGHT: 403.467083
SMILES: COC1=CC(=CC2=C1OCCO2)/C=C/C(=O)NCCSCC3=CC=CC=C3F
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[(3-fluorophenyl)methyl]piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(3-fluorophenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[(3-fluorophenyl)methyl]piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[(3-fluorophenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C21H28FN3O+2
MOLECULAR WEIGHT: 357.464923
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC(=CC=C3)F
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(3-fluorophenyl)methyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C21H26FN3O
MOLECULAR WEIGHT: 355.449043
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)F
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Product OPENEYE NAME: [2-(2-methylanilino)-2-oxo-ethyl] (2S)-2-(butylsulfonylamino)propanoate
CAS Name: (2S)-2-(butylsulfonylamino)propanoic acid [2-(2-methylanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(2-methylanilino)-2-oxoethyl] (2S)-2-(butylsulfonylamino)propanoate
SYSTEMATIC NAME: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-(butylsulfonylamino)propanoate
MOLECULAR FORMULA: C16H24N2O5S
MOLECULAR WEIGHT: 356.43716
SMILES: CCCCS(=O)(=O)N[C@@H](C)C(=O)OCC(=O)NC1=CC=CC=C1C
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Product OPENEYE NAME: N-ethyl-4-(4-nitrophenyl)sulfonyl-piperazine-1-carbothioamide
CAS Name: N-ethyl-4-(4-nitrophenyl)sulfonyl-1-piperazinecarbothioamide
IUPAC NAME: N-ethyl-4-(4-nitrophenyl)sulfonylpiperazine-1-carbothioamide
SYSTEMATIC NAME: N-ethyl-4-(4-nitrophenyl)sulfonyl-piperazine-1-carbothioamide
MOLECULAR FORMULA: C13H18N4O4S2
MOLECULAR WEIGHT: 358.43642
SMILES: CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[2-[[(1S)-1,2-dimethylpropyl]amino]-2-oxo-ethyl]piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethyl]piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxidanylidene-ethyl]piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C21H36N4O2+2
MOLECULAR WEIGHT: 376.53614
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC(=O)N[C@@H](C)C(C)C
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[2-[[(1S)-1,2-dimethylpropyl]amino]-2-oxo-ethyl]piperazin-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethyl]piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C21H34N4O2
MOLECULAR WEIGHT: 374.52026
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC(=O)N[C@@H](C)C(C)C
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Product OPENEYE NAME: (2S,3S)-N-(4-fluorophenyl)-3-methyl-2-phenyl-pentanamide
CAS Name: (2S,3S)-N-(4-fluorophenyl)-3-methyl-2-phenylpentanamide
IUPAC NAME: (2S,3S)-N-(4-fluorophenyl)-3-methyl-2-phenylpentanamide
SYSTEMATIC NAME: (2S,3S)-N-(4-fluorophenyl)-3-methyl-2-phenyl-pentanamide
MOLECULAR FORMULA: C18H20FNO
MOLECULAR WEIGHT: 285.355903
SMILES: CC[C@H](C)[C@@H](C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)F
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