Saturday, October 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-methyl-5-(2-methylthiazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-methyl-5-(2-methyl-4-thiazolyl)-1,2,4-triazol-3-yl]thio]acetamide
IUPAC NAME: N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-methyl-5-(2-methyl-1,3-thiazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
SYSTEMATIC NAME: N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-methyl-5-(2-methyl-1,3-thiazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide
MOLECULAR FORMULA: C17H13F6N5OS2
MOLECULAR WEIGHT: 481.438439
SMILES: CC1=NC(=CS1)C2=NN=C(N2C)SCC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: 3-[4-(1,3-dithiolan-2-yl)phenyl]-5-[[4-methyl-5-(2-methylthiazol-4-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,4-oxadiazole
CAS Name: 3-[4-(1,3-dithiolan-2-yl)phenyl]-5-[[[4-methyl-5-(2-methyl-4-thiazolyl)-1,2,4-triazol-3-yl]thio]methyl]-1,2,4-oxadiazole
IUPAC NAME: 3-[4-(1,3-dithiolan-2-yl)phenyl]-5-[[4-methyl-5-(2-methyl-1,3-thiazol-4-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[4-(1,3-dithiolan-2-yl)phenyl]-5-[[4-methyl-5-(2-methyl-1,3-thiazol-4-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C19H18N6OS4
MOLECULAR WEIGHT: 474.64582
SMILES: CC1=NC(=CS1)C2=NN=C(N2C)SCC3=NC(=NO3)C4=CC=C(C=C4)C5SCCS5
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Product OPENEYE NAME: 2-[[4-methyl-5-(2-methylthiazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide
CAS Name: 2-[[4-methyl-5-(2-methyl-4-thiazolyl)-1,2,4-triazol-3-yl]thio]-N-[4-(trifluoromethyl)phenyl]acetamide
IUPAC NAME: 2-[[4-methyl-5-(2-methyl-1,3-thiazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide
SYSTEMATIC NAME: 2-[[4-methyl-5-(2-methyl-1,3-thiazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethyl)phenyl]ethanamide
MOLECULAR FORMULA: C16H14F3N5OS2
MOLECULAR WEIGHT: 413.44047
SMILES: CC1=NC(=CS1)C2=NN=C(N2C)SCC(=O)NC3=CC=C(C=C3)C(F)(F)F
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Product OPENEYE NAME: 1-(4-fluorophenyl)-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanone
CAS Name: 1-(4-fluorophenyl)-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]thio]ethanone
IUPAC NAME: 1-(4-fluorophenyl)-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanone
SYSTEMATIC NAME: 1-(4-fluorophenyl)-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanone
MOLECULAR FORMULA: C17H11F4N3OS
MOLECULAR WEIGHT: 381.347353
SMILES: C1=CC(=CC=C1C(=O)CSC2=NN=CN2C3=CC=C(C=C3)C(F)(F)F)F
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Product OPENEYE NAME: 1-(benzofuran-2-yl)-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanone
CAS Name: 1-(2-benzofuranyl)-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]thio]ethanone
IUPAC NAME: 1-(1-benzofuran-2-yl)-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanone
SYSTEMATIC NAME: 1-(1-benzofuran-2-yl)-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanone
MOLECULAR FORMULA: C19H12F3N3O2S
MOLECULAR WEIGHT: 403.37769
SMILES: C1=CC=C2C(=C1)C=C(O2)C(=O)CSC3=NN=CN3C4=CC=C(C=C4)C(F)(F)F
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Product OPENEYE NAME: N-[4-(trifluoromethyl)phenyl]-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
CAS Name: N-[4-(trifluoromethyl)phenyl]-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]thio]acetamide
IUPAC NAME: N-[4-(trifluoromethyl)phenyl]-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
SYSTEMATIC NAME: N-[4-(trifluoromethyl)phenyl]-2-[[4-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide
MOLECULAR FORMULA: C18H12F6N4OS
MOLECULAR WEIGHT: 446.369499
SMILES: C1=CC(=CC=C1C(F)(F)F)NC(=O)CSC2=NN=CN2C3=CC=C(C=C3)C(F)(F)F
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Product OPENEYE NAME: 1-(4-tert-butylphenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
CAS Name: 1-(4-tert-butylphenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
IUPAC NAME: 1-(4-tert-butylphenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
SYSTEMATIC NAME: 1-(4-tert-butylphenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
MOLECULAR FORMULA: C16H19F3N2O2S
MOLECULAR WEIGHT: 360.39447
SMILES: CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN=C(C=C2)C(F)(F)F
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Product OPENEYE NAME: 1-(3-chlorophenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
CAS Name: 1-(3-chlorophenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
IUPAC NAME: 1-(3-chlorophenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
SYSTEMATIC NAME: 1-(3-chlorophenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
MOLECULAR FORMULA: C12H10ClF3N2O2S
MOLECULAR WEIGHT: 338.73321
SMILES: C1CN(C=CC(=N1)C(F)(F)F)S(=O)(=O)C2=CC(=CC=C2)Cl
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Product OPENEYE NAME: 1-(4-fluorophenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
CAS Name: 1-(4-fluorophenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
IUPAC NAME: 1-(4-fluorophenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
SYSTEMATIC NAME: 1-(4-fluorophenyl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
MOLECULAR FORMULA: C12H10F4N2O2S
MOLECULAR WEIGHT: 322.278613
SMILES: C1CN(C=CC(=N1)C(F)(F)F)S(=O)(=O)C2=CC=C(C=C2)F
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Product OPENEYE NAME: 1-[(4-bromo-5-chloro-2-thienyl)sulfonyl]-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
CAS Name: 1-[(4-bromo-5-chloro-2-thiophenyl)sulfonyl]-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
IUPAC NAME: 1-(4-bromo-5-chlorothiophen-2-yl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
SYSTEMATIC NAME: 1-(4-bromanyl-5-chloranyl-thiophen-2-yl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
MOLECULAR FORMULA: C10H7BrClF3N2O2S2
MOLECULAR WEIGHT: 423.65699
SMILES: C1CN(C=CC(=N1)C(F)(F)F)S(=O)(=O)C2=CC(=C(S2)Cl)Br
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Product OPENEYE NAME: 1-[(2,5-dichloro-3-thienyl)sulfonyl]-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
CAS Name: 1-[(2,5-dichloro-3-thiophenyl)sulfonyl]-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
IUPAC NAME: 1-(2,5-dichlorothiophen-3-yl)sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
SYSTEMATIC NAME: 1-[2,5-bis(chloranyl)thiophen-3-yl]sulfonyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
MOLECULAR FORMULA: C10H7Cl2F3N2O2S2
MOLECULAR WEIGHT: 379.20599
SMILES: C1CN(C=CC(=N1)C(F)(F)F)S(=O)(=O)C2=C(SC(=C2)Cl)Cl
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Product OPENEYE NAME: N-[[5-[[5-(trifluoromethyl)-2,3-dihydro-1,4-diazepin-1-yl]sulfonyl]-2-thienyl]methyl]benzamide
CAS Name: N-[[5-[[5-(trifluoromethyl)-2,3-dihydro-1,4-diazepin-1-yl]sulfonyl]-2-thiophenyl]methyl]benzamide
IUPAC NAME: N-[[5-[[5-(trifluoromethyl)-2,3-dihydro-1,4-diazepin-1-yl]sulfonyl]thiophen-2-yl]methyl]benzamide
SYSTEMATIC NAME: N-[[5-[[5-(trifluoromethyl)-2,3-dihydro-1,4-diazepin-1-yl]sulfonyl]thiophen-2-yl]methyl]benzamide
MOLECULAR FORMULA: C18H16F3N3O3S2
MOLECULAR WEIGHT: 443.46315
SMILES: C1CN(C=CC(=N1)C(F)(F)F)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 8-[[5-(trifluoromethyl)-2,3-dihydro-1,4-diazepin-1-yl]sulfonyl]quinoline
CAS Name: 8-[[5-(trifluoromethyl)-2,3-dihydro-1,4-diazepin-1-yl]sulfonyl]quinoline
IUPAC NAME: 8-[[5-(trifluoromethyl)-2,3-dihydro-1,4-diazepin-1-yl]sulfonyl]quinoline
SYSTEMATIC NAME: 8-[[5-(trifluoromethyl)-2,3-dihydro-1,4-diazepin-1-yl]sulfonyl]quinoline
MOLECULAR FORMULA: C15H12F3N3O2S
MOLECULAR WEIGHT: 355.33489
SMILES: C1CN(C=CC(=N1)C(F)(F)F)S(=O)(=O)C2=CC=CC3=C2N=CC=C3
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Product OPENEYE NAME: ethyl (2R)-2-[(4-bromo-5-chloro-2-thienyl)sulfonylamino]-3-methyl-butanoate
CAS Name: (2R)-2-[(4-bromo-5-chloro-2-thiophenyl)sulfonylamino]-3-methylbutanoic acid ethyl ester
IUPAC NAME: ethyl (2R)-2-[(4-bromo-5-chlorothiophen-2-yl)sulfonylamino]-3-methylbutanoate
SYSTEMATIC NAME: ethyl (2R)-2-[(4-bromanyl-5-chloranyl-thiophen-2-yl)sulfonylamino]-3-methyl-butanoate
MOLECULAR FORMULA: C11H15BrClNO4S2
MOLECULAR WEIGHT: 404.7281
SMILES: CCOC(=O)[C@@H](C(C)C)NS(=O)(=O)C1=CC(=C(S1)Cl)Br
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-yl)-2-[4-[2-(4-chlorophenyl)-4-methyl-thiazol-5-yl]pyrimidin-2-yl]sulfanyl-acetamide
CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[4-[2-(4-chlorophenyl)-4-methyl-5-thiazolyl]-2-pyrimidinyl]thio]acetamide
IUPAC NAME: N-(1,3-benzodioxol-5-yl)-2-[4-[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]pyrimidin-2-yl]sulfanylacetamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-yl)-2-[4-[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]pyrimidin-2-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C23H17ClN4O3S2
MOLECULAR WEIGHT: 496.98908
SMILES: CC1=C(SC(=N1)C2=CC=C(C=C2)Cl)C3=NC(=NC=C3)SCC(=O)NC4=CC5=C(C=C4)OCO5
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Product OPENEYE NAME: N-[4-(5-chloro-2-thienyl)thiazol-2-yl]-N-methyl-propanamide
CAS Name: N-[4-(5-chloro-2-thiophenyl)-2-thiazolyl]-N-methylpropanamide
IUPAC NAME: N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-N-methylpropanamide
SYSTEMATIC NAME: N-[4-(5-chloranylthiophen-2-yl)-1,3-thiazol-2-yl]-N-methyl-propanamide
MOLECULAR FORMULA: C11H11ClN2OS2
MOLECULAR WEIGHT: 286.80084
SMILES: CCC(=O)N(C)C1=NC(=CS1)C2=CC=C(S2)Cl
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Product OPENEYE NAME: N-[4-(5-chloro-2-thienyl)thiazol-2-yl]-N-methyl-cyclohexanecarboxamide
CAS Name: N-[4-(5-chloro-2-thiophenyl)-2-thiazolyl]-N-methylcyclohexanecarboxamide
IUPAC NAME: N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-N-methylcyclohexanecarboxamide
SYSTEMATIC NAME: N-[4-(5-chloranylthiophen-2-yl)-1,3-thiazol-2-yl]-N-methyl-cyclohexanecarboxamide
MOLECULAR FORMULA: C15H17ClN2OS2
MOLECULAR WEIGHT: 340.89128
SMILES: CN(C1=NC(=CS1)C2=CC=C(S2)Cl)C(=O)C3CCCCC3
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