Monday, October 1, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N-[[2-(cyclopentoxy)-4-pyridyl]methyl]azepane-1-sulfonamide
CAS Name: N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-azepanesulfonamide
IUPAC NAME: N-[(2-cyclopentyloxypyridin-4-yl)methyl]azepane-1-sulfonamide
SYSTEMATIC NAME: N-[(2-cyclopentyloxypyridin-4-yl)methyl]azepane-1-sulfonamide
MOLECULAR FORMULA: C17H27N3O3S
MOLECULAR WEIGHT: 353.47958
SMILES: C1CCCN(CC1)S(=O)(=O)NCC2=CC(=NC=C2)OC3CCCC3
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Product OPENEYE NAME: N-methyl-3-(p-tolyl)-N-[(1R)-1,2,2-trimethylpropyl]-1H-pyrazole-5-carboxamide
CAS Name: N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
IUPAC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
SYSTEMATIC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
MOLECULAR FORMULA: C18H25N3O
MOLECULAR WEIGHT: 299.4106
SMILES: CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N(C)[C@H](C)C(C)(C)C
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Product OPENEYE NAME: N-methyl-3-(p-tolyl)-N-[(1S)-1,2,2-trimethylpropyl]-1H-pyrazole-5-carboxamide
CAS Name: N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
IUPAC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
SYSTEMATIC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
MOLECULAR FORMULA: C18H25N3O
MOLECULAR WEIGHT: 299.4106
SMILES: CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N(C)[C@@H](C)C(C)(C)C
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Product OPENEYE NAME: N-[[5-[[(2R)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butyl]sulfamoyl]-2-thienyl]methyl]acetamide
CAS Name: N-[[5-[[(2R)-3-methyl-2-(4-methyl-1-piperidin-1-iumyl)butyl]sulfamoyl]-2-thiophenyl]methyl]acetamide
IUPAC NAME: N-[[5-[[(2R)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butyl]sulfamoyl]thiophen-2-yl]methyl]acetamide
SYSTEMATIC NAME: N-[[5-[[(2R)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butyl]sulfamoyl]thiophen-2-yl]methyl]ethanamide
MOLECULAR FORMULA: C18H32N3O3S2+
MOLECULAR WEIGHT: 402.59498
SMILES: CC1CC[NH+](CC1)[C@@H](CNS(=O)(=O)C2=CC=C(S2)CNC(=O)C)C(C)C
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Product OPENEYE NAME: N-[[5-[[(2R)-3-methyl-2-(4-methyl-1-piperidyl)butyl]sulfamoyl]-2-thienyl]methyl]acetamide
CAS Name: N-[[5-[[(2R)-3-methyl-2-(4-methyl-1-piperidinyl)butyl]sulfamoyl]-2-thiophenyl]methyl]acetamide
IUPAC NAME: N-[[5-[[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]sulfamoyl]thiophen-2-yl]methyl]acetamide
SYSTEMATIC NAME: N-[[5-[[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]sulfamoyl]thiophen-2-yl]methyl]ethanamide
MOLECULAR FORMULA: C18H31N3O3S2
MOLECULAR WEIGHT: 401.58704
SMILES: CC1CCN(CC1)[C@@H](CNS(=O)(=O)C2=CC=C(S2)CNC(=O)C)C(C)C
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Product OPENEYE NAME: N-[[5-[[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butyl]sulfamoyl]-2-thienyl]methyl]acetamide
CAS Name: N-[[5-[[(2S)-3-methyl-2-(4-methyl-1-piperidin-1-iumyl)butyl]sulfamoyl]-2-thiophenyl]methyl]acetamide
IUPAC NAME: N-[[5-[[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butyl]sulfamoyl]thiophen-2-yl]methyl]acetamide
SYSTEMATIC NAME: N-[[5-[[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butyl]sulfamoyl]thiophen-2-yl]methyl]ethanamide
MOLECULAR FORMULA: C18H32N3O3S2+
MOLECULAR WEIGHT: 402.59498
SMILES: CC1CC[NH+](CC1)[C@H](CNS(=O)(=O)C2=CC=C(S2)CNC(=O)C)C(C)C
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Product OPENEYE NAME: N-[[5-[[(2S)-3-methyl-2-(4-methyl-1-piperidyl)butyl]sulfamoyl]-2-thienyl]methyl]acetamide
CAS Name: N-[[5-[[(2S)-3-methyl-2-(4-methyl-1-piperidinyl)butyl]sulfamoyl]-2-thiophenyl]methyl]acetamide
IUPAC NAME: N-[[5-[[(2S)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]sulfamoyl]thiophen-2-yl]methyl]acetamide
SYSTEMATIC NAME: N-[[5-[[(2S)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]sulfamoyl]thiophen-2-yl]methyl]ethanamide
MOLECULAR FORMULA: C18H31N3O3S2
MOLECULAR WEIGHT: 401.58704
SMILES: CC1CCN(CC1)[C@H](CNS(=O)(=O)C2=CC=C(S2)CNC(=O)C)C(C)C
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Product OPENEYE NAME: N-methyl-6-oxo-1-(2-phenoxyethyl)-N-[(1R)-1,2,2-trimethylpropyl]pyridazine-3-carboxamide
CAS Name: N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide
IUPAC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide
SYSTEMATIC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide
MOLECULAR FORMULA: C20H27N3O3
MOLECULAR WEIGHT: 357.44668
SMILES: C[C@H](C(C)(C)C)N(C)C(=O)C1=NN(C(=O)C=C1)CCOC2=CC=CC=C2
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Product OPENEYE NAME: N-methyl-6-oxo-1-(2-phenoxyethyl)-N-[(1S)-1,2,2-trimethylpropyl]pyridazine-3-carboxamide
CAS Name: N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide
IUPAC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide
SYSTEMATIC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide
MOLECULAR FORMULA: C20H27N3O3
MOLECULAR WEIGHT: 357.44668
SMILES: C[C@@H](C(C)(C)C)N(C)C(=O)C1=NN(C(=O)C=C1)CCOC2=CC=CC=C2
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Product OPENEYE NAME: N,1-dimethyl-N-[(1R)-1,2,2-trimethylpropyl]indole-3-carboxamide
CAS Name: N-[(2R)-3,3-dimethylbutan-2-yl]-N,1-dimethyl-3-indolecarboxamide
IUPAC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-N,1-dimethylindole-3-carboxamide
SYSTEMATIC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-N,1-dimethyl-indole-3-carboxamide
MOLECULAR FORMULA: C17H24N2O
MOLECULAR WEIGHT: 272.38526
SMILES: C[C@H](C(C)(C)C)N(C)C(=O)C1=CN(C2=CC=CC=C21)C
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Product OPENEYE NAME: N,1-dimethyl-N-[(1S)-1,2,2-trimethylpropyl]indole-3-carboxamide
CAS Name: N-[(2S)-3,3-dimethylbutan-2-yl]-N,1-dimethyl-3-indolecarboxamide
IUPAC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-N,1-dimethylindole-3-carboxamide
SYSTEMATIC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-N,1-dimethyl-indole-3-carboxamide
MOLECULAR FORMULA: C17H24N2O
MOLECULAR WEIGHT: 272.38526
SMILES: C[C@@H](C(C)(C)C)N(C)C(=O)C1=CN(C2=CC=CC=C21)C
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Product OPENEYE NAME: (E)-3-(4-cyanophenyl)-N-methyl-N-[(1R)-1,2,2-trimethylpropyl]prop-2-enamide
CAS Name: (E)-3-(4-cyanophenyl)-N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-2-propenamide
IUPAC NAME: (E)-3-(4-cyanophenyl)-N-[(2R)-3,3-dimethylbutan-2-yl]-N-methylprop-2-enamide
SYSTEMATIC NAME: (E)-3-(4-cyanophenyl)-N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-prop-2-enamide
MOLECULAR FORMULA: C17H22N2O
MOLECULAR WEIGHT: 270.36938
SMILES: C[C@H](C(C)(C)C)N(C)C(=O)/C=C/C1=CC=C(C=C1)C#N
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Product OPENEYE NAME: (E)-3-(4-cyanophenyl)-N-methyl-N-[(1S)-1,2,2-trimethylpropyl]prop-2-enamide
CAS Name: (E)-3-(4-cyanophenyl)-N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-2-propenamide
IUPAC NAME: (E)-3-(4-cyanophenyl)-N-[(2S)-3,3-dimethylbutan-2-yl]-N-methylprop-2-enamide
SYSTEMATIC NAME: (E)-3-(4-cyanophenyl)-N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-prop-2-enamide
MOLECULAR FORMULA: C17H22N2O
MOLECULAR WEIGHT: 270.36938
SMILES: C[C@@H](C(C)(C)C)N(C)C(=O)/C=C/C1=CC=C(C=C1)C#N
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Product OPENEYE NAME: 3-(methanesulfonamido)-N-methyl-N-[(1R)-1,2,2-trimethylpropyl]benzamide
CAS Name: N-[(2R)-3,3-dimethylbutan-2-yl]-3-(methanesulfonamido)-N-methylbenzamide
IUPAC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-3-(methanesulfonamido)-N-methylbenzamide
SYSTEMATIC NAME: N-[(2R)-3,3-dimethylbutan-2-yl]-N-methyl-3-(methylsulfonylamino)benzamide
MOLECULAR FORMULA: C15H24N2O3S
MOLECULAR WEIGHT: 312.42766
SMILES: C[C@H](C(C)(C)C)N(C)C(=O)C1=CC(=CC=C1)NS(=O)(=O)C
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Product OPENEYE NAME: 3-(methanesulfonamido)-N-methyl-N-[(1S)-1,2,2-trimethylpropyl]benzamide
CAS Name: N-[(2S)-3,3-dimethylbutan-2-yl]-3-(methanesulfonamido)-N-methylbenzamide
IUPAC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-3-(methanesulfonamido)-N-methylbenzamide
SYSTEMATIC NAME: N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-3-(methylsulfonylamino)benzamide
MOLECULAR FORMULA: C15H24N2O3S
MOLECULAR WEIGHT: 312.42766
SMILES: C[C@@H](C(C)(C)C)N(C)C(=O)C1=CC(=CC=C1)NS(=O)(=O)C
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Product OPENEYE NAME: N-[2-[methyl-[(1R)-1,2,2-trimethylpropyl]amino]-2-oxo-ethyl]-2-phenyl-acetamide
CAS Name: N-[2-[[(2R)-3,3-dimethylbutan-2-yl]-methylamino]-2-oxoethyl]-2-phenylacetamide
IUPAC NAME: N-[2-[[(2R)-3,3-dimethylbutan-2-yl]-methylamino]-2-oxoethyl]-2-phenylacetamide
SYSTEMATIC NAME: N-[2-[[(2R)-3,3-dimethylbutan-2-yl]-methyl-amino]-2-oxidanylidene-ethyl]-2-phenyl-ethanamide
MOLECULAR FORMULA: C17H26N2O2
MOLECULAR WEIGHT: 290.40054
SMILES: C[C@H](C(C)(C)C)N(C)C(=O)CNC(=O)CC1=CC=CC=C1
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