Friday, March 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1-(benzenesulfonyl)-N-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide
CAS Name: 1-(benzenesulfonyl)-N-[(2-methoxyphenyl)methyl]-4-piperidinecarboxamide
IUPAC NAME: 1-(benzenesulfonyl)-N-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide
SYSTEMATIC NAME: N-[(2-methoxyphenyl)methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide
MOLECULAR FORMULA: C20H24N2O4S
MOLECULAR WEIGHT: 388.48056
SMILES: COC1=CC=CC=C1CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 1-(benzenesulfonyl)-N-benzyl-piperidine-4-carboxamide
CAS Name: 1-(benzenesulfonyl)-N-(phenylmethyl)-4-piperidinecarboxamide
IUPAC NAME: 1-(benzenesulfonyl)-N-benzylpiperidine-4-carboxamide
SYSTEMATIC NAME: N-(phenylmethyl)-1-(phenylsulfonyl)piperidine-4-carboxamide
MOLECULAR FORMULA: C19H22N2O3S
MOLECULAR WEIGHT: 358.45458
SMILES: C1CN(CCC1C(=O)NCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 1-(benzenesulfonyl)-N-cyclohexyl-piperidine-4-carboxamide
CAS Name: 1-(benzenesulfonyl)-N-cyclohexyl-4-piperidinecarboxamide
IUPAC NAME: 1-(benzenesulfonyl)-N-cyclohexylpiperidine-4-carboxamide
SYSTEMATIC NAME: N-cyclohexyl-1-(phenylsulfonyl)piperidine-4-carboxamide
MOLECULAR FORMULA: C18H26N2O3S
MOLECULAR WEIGHT: 350.47564
SMILES: C1CCC(CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: N-(2,5-dimethoxyphenyl)-2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide
CAS Name: N-(2,5-dimethoxyphenyl)-2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]acetamide
IUPAC NAME: N-(2,5-dimethoxyphenyl)-2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide
SYSTEMATIC NAME: N-(2,5-dimethoxyphenyl)-2-[(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide
MOLECULAR FORMULA: C17H21N3O4S
MOLECULAR WEIGHT: 363.43134
SMILES: CCC1=C(NC(=NC1=O)SCC(=O)NC2=C(C=CC(=C2)OC)OC)C
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Product OPENEYE NAME: 2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
CAS Name: 2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide
IUPAC NAME: 2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
SYSTEMATIC NAME: 2-[(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]ethanamide
MOLECULAR FORMULA: C16H16F3N3O2S
MOLECULAR WEIGHT: 371.37735
SMILES: CCC1=C(NC(=NC1=O)SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)C
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Product OPENEYE NAME: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide
CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]acetamide
IUPAC NAME: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide
SYSTEMATIC NAME: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-[(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide
MOLECULAR FORMULA: C16H15ClF3N3O2S
MOLECULAR WEIGHT: 405.82241
SMILES: CCC1=C(NC(=NC1=O)SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)C
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Product OPENEYE NAME: methyl 4-[[2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzoate
CAS Name: 4-[[2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-1-oxoethyl]amino]benzoic acid methyl ester
IUPAC NAME: methyl 4-[[2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzoate
SYSTEMATIC NAME: methyl 4-[2-[(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]benzoate
MOLECULAR FORMULA: C17H19N3O4S
MOLECULAR WEIGHT: 361.41546
SMILES: CCC1=C(NC(=NC1=O)SCC(=O)NC2=CC=C(C=C2)C(=O)OC)C
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Product OPENEYE NAME: 2-[(6-amino-7H-purin-8-yl)sulfanyl]-N-(4-bromophenyl)acetamide
CAS Name: 2-[(6-amino-7H-purin-8-yl)thio]-N-(4-bromophenyl)acetamide
IUPAC NAME: 2-[(6-amino-7H-purin-8-yl)sulfanyl]-N-(4-bromophenyl)acetamide
SYSTEMATIC NAME: 2-[(6-azanyl-7H-purin-8-yl)sulfanyl]-N-(4-bromophenyl)ethanamide
MOLECULAR FORMULA: C13H11BrN6OS
MOLECULAR WEIGHT: 379.23504
SMILES: C1=CC(=CC=C1NC(=O)CSC2=NC3=C(N2)C(=NC=N3)N)Br
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Product OPENEYE NAME: 7-[(2-fluorophenyl)methyl]-1,3-dimethyl-8-(3-pyridylmethylamino)purine-2,6-dione
CAS Name: 7-[(2-fluorophenyl)methyl]-1,3-dimethyl-8-(3-pyridinylmethylamino)purine-2,6-dione
IUPAC NAME: 7-[(2-fluorophenyl)methyl]-1,3-dimethyl-8-(pyridin-3-ylmethylamino)purine-2,6-dione
SYSTEMATIC NAME: 7-[(2-fluorophenyl)methyl]-1,3-dimethyl-8-(pyridin-3-ylmethylamino)purine-2,6-dione
MOLECULAR FORMULA: C20H19FN6O2
MOLECULAR WEIGHT: 394.402263
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCC3=CN=CC=C3)CC4=CC=CC=C4F
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Product OPENEYE NAME: 1-[(2-fluorophenyl)methyl]-3,7-dimethyl-8-(2-pyridylmethylamino)purine-2,6-dione
CAS Name: 1-[(2-fluorophenyl)methyl]-3,7-dimethyl-8-(2-pyridinylmethylamino)purine-2,6-dione
IUPAC NAME: 1-[(2-fluorophenyl)methyl]-3,7-dimethyl-8-(pyridin-2-ylmethylamino)purine-2,6-dione
SYSTEMATIC NAME: 1-[(2-fluorophenyl)methyl]-3,7-dimethyl-8-(pyridin-2-ylmethylamino)purine-2,6-dione
MOLECULAR FORMULA: C20H19FN6O2
MOLECULAR WEIGHT: 394.402263
SMILES: CN1C2=C(N=C1NCC3=CC=CC=N3)N(C(=O)N(C2=O)CC4=CC=CC=C4F)C
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Product OPENEYE NAME: 8-(1,3-benzodioxol-5-ylmethoxy)-1-[(4-fluorophenyl)methyl]-3,7-dimethyl-purine-2,6-dione
CAS Name: 8-(1,3-benzodioxol-5-ylmethoxy)-1-[(4-fluorophenyl)methyl]-3,7-dimethylpurine-2,6-dione
IUPAC NAME: 8-(1,3-benzodioxol-5-ylmethoxy)-1-[(4-fluorophenyl)methyl]-3,7-dimethylpurine-2,6-dione
SYSTEMATIC NAME: 8-(1,3-benzodioxol-5-ylmethoxy)-1-[(4-fluorophenyl)methyl]-3,7-dimethyl-purine-2,6-dione
MOLECULAR FORMULA: C22H19FN4O5
MOLECULAR WEIGHT: 438.408463
SMILES: CN1C2=C(N=C1OCC3=CC4=C(C=C3)OCO4)N(C(=O)N(C2=O)CC5=CC=C(C=C5)F)C
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Product OPENEYE NAME: 1-benzyl-8-(4-methoxyphenoxy)-3,7-dimethyl-purine-2,6-dione
CAS Name: 8-(4-methoxyphenoxy)-3,7-dimethyl-1-(phenylmethyl)purine-2,6-dione
IUPAC NAME: 1-benzyl-8-(4-methoxyphenoxy)-3,7-dimethylpurine-2,6-dione
SYSTEMATIC NAME: 8-(4-methoxyphenoxy)-3,7-dimethyl-1-(phenylmethyl)purine-2,6-dione
MOLECULAR FORMULA: C21H20N4O4
MOLECULAR WEIGHT: 392.4079
SMILES: CN1C2=C(N=C1OC3=CC=C(C=C3)OC)N(C(=O)N(C2=O)CC4=CC=CC=C4)C
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Product OPENEYE NAME: 1-[(4-fluorophenyl)methyl]-3,7-dimethyl-8-(1-piperidyl)purine-2,6-dione
CAS Name: 1-[(4-fluorophenyl)methyl]-3,7-dimethyl-8-(1-piperidinyl)purine-2,6-dione
IUPAC NAME: 1-[(4-fluorophenyl)methyl]-3,7-dimethyl-8-piperidin-1-ylpurine-2,6-dione
SYSTEMATIC NAME: 1-[(4-fluorophenyl)methyl]-3,7-dimethyl-8-piperidin-1-yl-purine-2,6-dione
MOLECULAR FORMULA: C19H22FN5O2
MOLECULAR WEIGHT: 371.408683
SMILES: CN1C2=C(N=C1N3CCCCC3)N(C(=O)N(C2=O)CC4=CC=C(C=C4)F)C
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Product OPENEYE NAME: 8-(3,5-dimethylphenoxy)-7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-purine-2,6-dione
CAS Name: 8-(3,5-dimethylphenoxy)-7-[(3-methoxyphenyl)methyl]-1,3-dimethylpurine-2,6-dione
IUPAC NAME: 8-(3,5-dimethylphenoxy)-7-[(3-methoxyphenyl)methyl]-1,3-dimethylpurine-2,6-dione
SYSTEMATIC NAME: 8-(3,5-dimethylphenoxy)-7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-purine-2,6-dione
MOLECULAR FORMULA: C23H24N4O4
MOLECULAR WEIGHT: 420.46106
SMILES: CC1=CC(=CC(=C1)OC2=NC3=C(N2CC4=CC(=CC=C4)OC)C(=O)N(C(=O)N3C)C)C
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Product OPENEYE NAME: 8-(2-furylmethylamino)-3,7-dimethyl-1-(2-phenylethyl)purine-2,6-dione
CAS Name: 8-(2-furanylmethylamino)-3,7-dimethyl-1-(2-phenylethyl)purine-2,6-dione
IUPAC NAME: 8-(furan-2-ylmethylamino)-3,7-dimethyl-1-(2-phenylethyl)purine-2,6-dione
SYSTEMATIC NAME: 8-(furan-2-ylmethylamino)-3,7-dimethyl-1-(2-phenylethyl)purine-2,6-dione
MOLECULAR FORMULA: C20H21N5O3
MOLECULAR WEIGHT: 379.41244
SMILES: CN1C2=C(N=C1NCC3=CC=CO3)N(C(=O)N(C2=O)CCC4=CC=CC=C4)C
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Product OPENEYE NAME: 1-[(2-fluorophenyl)methyl]-8-(4-methoxyphenoxy)-3,7-dimethyl-purine-2,6-dione
CAS Name: 1-[(2-fluorophenyl)methyl]-8-(4-methoxyphenoxy)-3,7-dimethylpurine-2,6-dione
IUPAC NAME: 1-[(2-fluorophenyl)methyl]-8-(4-methoxyphenoxy)-3,7-dimethylpurine-2,6-dione
SYSTEMATIC NAME: 1-[(2-fluorophenyl)methyl]-8-(4-methoxyphenoxy)-3,7-dimethyl-purine-2,6-dione
MOLECULAR FORMULA: C21H19FN4O4
MOLECULAR WEIGHT: 410.398363
SMILES: CN1C2=C(N=C1OC3=CC=C(C=C3)OC)N(C(=O)N(C2=O)CC4=CC=CC=C4F)C
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Product OPENEYE NAME: 1,3-dimethyl-8-morpholino-7-[[3-(trifluoromethyl)phenyl]methyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-8-(4-morpholinyl)-7-[[3-(trifluoromethyl)phenyl]methyl]purine-2,6-dione
IUPAC NAME: 1,3-dimethyl-8-morpholin-4-yl-7-[[3-(trifluoromethyl)phenyl]methyl]purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-morpholin-4-yl-7-[[3-(trifluoromethyl)phenyl]methyl]purine-2,6-dione
MOLECULAR FORMULA: C19H20F3N5O3
MOLECULAR WEIGHT: 423.38901
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCOCC3)CC4=CC(=CC=C4)C(F)(F)F
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Product OPENEYE NAME: 1-[(4-fluorophenyl)methyl]-3,7-dimethyl-8-(3-pyridylmethoxy)purine-2,6-dione
CAS Name: 1-[(4-fluorophenyl)methyl]-3,7-dimethyl-8-(3-pyridinylmethoxy)purine-2,6-dione
IUPAC NAME: 1-[(4-fluorophenyl)methyl]-3,7-dimethyl-8-(pyridin-3-ylmethoxy)purine-2,6-dione
SYSTEMATIC NAME: 1-[(4-fluorophenyl)methyl]-3,7-dimethyl-8-(pyridin-3-ylmethoxy)purine-2,6-dione
MOLECULAR FORMULA: C20H18FN5O3
MOLECULAR WEIGHT: 395.387023
SMILES: CN1C2=C(N=C1OCC3=CN=CC=C3)N(C(=O)N(C2=O)CC4=CC=C(C=C4)F)C
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Product OPENEYE NAME: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-(1-piperidyl)purine-2,6-dione
CAS Name: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-(1-piperidinyl)purine-2,6-dione
IUPAC NAME: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-piperidin-1-ylpurine-2,6-dione
SYSTEMATIC NAME: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-piperidin-1-yl-purine-2,6-dione
MOLECULAR FORMULA: C20H25N5O3
MOLECULAR WEIGHT: 383.4442
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CC4=CC(=CC=C4)OC
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