Friday, November 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: methyl 3-(1-benzyl-2,6-dioxo-7H-purin-3-yl)benzoate
CAS Name: 3-[2,6-dioxo-1-(phenylmethyl)-7H-purin-3-yl]benzoic acid methyl ester
IUPAC NAME: methyl 3-(1-benzyl-2,6-dioxo-7H-purin-3-yl)benzoate
SYSTEMATIC NAME: methyl 3-[2,6-bis(oxidanylidene)-1-(phenylmethyl)-7H-purin-3-yl]benzoate
MOLECULAR FORMULA: C20H16N4O4
MOLECULAR WEIGHT: 376.36544
SMILES: COC(=O)C1=CC(=CC=C1)N2C3=C(C(=O)N(C2=O)CC4=CC=CC=C4)NC=N3
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Product OPENEYE NAME: 1-benzyl-3-(4-methoxyphenyl)urea
CAS Name: 1-(4-methoxyphenyl)-3-(phenylmethyl)urea
IUPAC NAME: 1-benzyl-3-(4-methoxyphenyl)urea
SYSTEMATIC NAME: 1-(4-methoxyphenyl)-3-(phenylmethyl)urea
MOLECULAR FORMULA: C15H16N2O2
MOLECULAR WEIGHT: 256.29974
SMILES: COC1=CC=C(C=C1)NC(=O)NCC2=CC=CC=C2
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Product OPENEYE NAME: N-(2-cyanoethyl)-N-indan-1-yl-3,4-dimethoxy-benzenesulfonamide
CAS Name: N-(2-cyanoethyl)-N-(2,3-dihydro-1H-inden-1-yl)-3,4-dimethoxybenzenesulfonamide
IUPAC NAME: N-(2-cyanoethyl)-N-(2,3-dihydro-1H-inden-1-yl)-3,4-dimethoxybenzenesulfonamide
SYSTEMATIC NAME: N-(2-cyanoethyl)-N-(2,3-dihydro-1H-inden-1-yl)-3,4-dimethoxy-benzenesulfonamide
MOLECULAR FORMULA: C20H22N2O4S
MOLECULAR WEIGHT: 386.46468
SMILES: COC1=C(C=C(C=C1)S(=O)(=O)N(CCC#N)C2CCC3=CC=CC=C23)OC
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Product OPENEYE NAME: N-benzyl-N-[(3-chlorophenyl)carbamoyl]-2-cyano-acetamide
CAS Name: N-[(3-chloroanilino)-oxomethyl]-2-cyano-N-(phenylmethyl)acetamide
IUPAC NAME: N-benzyl-N-[(3-chlorophenyl)carbamoyl]-2-cyanoacetamide
SYSTEMATIC NAME: N-[(3-chlorophenyl)carbamoyl]-2-cyano-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C17H14ClN3O2
MOLECULAR WEIGHT: 327.76496
SMILES: C1=CC=C(C=C1)CN(C(=O)CC#N)C(=O)NC2=CC(=CC=C2)Cl
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Product OPENEYE NAME: 1-benzyl-3-(4-fluorophenyl)urea
CAS Name: 1-(4-fluorophenyl)-3-(phenylmethyl)urea
IUPAC NAME: 1-benzyl-3-(4-fluorophenyl)urea
SYSTEMATIC NAME: 1-(4-fluorophenyl)-3-(phenylmethyl)urea
MOLECULAR FORMULA: C14H13FN2O
MOLECULAR WEIGHT: 244.264223
SMILES: C1=CC=C(C=C1)CNC(=O)NC2=CC=C(C=C2)F
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Product OPENEYE NAME: 1-benzyl-3-(3-fluorophenyl)urea
CAS Name: 1-(3-fluorophenyl)-3-(phenylmethyl)urea
IUPAC NAME: 1-benzyl-3-(3-fluorophenyl)urea
SYSTEMATIC NAME: 1-(3-fluorophenyl)-3-(phenylmethyl)urea
MOLECULAR FORMULA: C14H13FN2O
MOLECULAR WEIGHT: 244.264223
SMILES: C1=CC=C(C=C1)CNC(=O)NC2=CC(=CC=C2)F
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Product OPENEYE NAME: N-benzyl-2-cyano-N-[(4-methoxyphenyl)carbamoyl]acetamide
CAS Name: 2-cyano-N-[(4-methoxyanilino)-oxomethyl]-N-(phenylmethyl)acetamide
IUPAC NAME: N-benzyl-2-cyano-N-[(4-methoxyphenyl)carbamoyl]acetamide
SYSTEMATIC NAME: 2-cyano-N-[(4-methoxyphenyl)carbamoyl]-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C18H17N3O3
MOLECULAR WEIGHT: 323.34588
SMILES: COC1=CC=C(C=C1)NC(=O)N(CC2=CC=CC=C2)C(=O)CC#N
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Product OPENEYE NAME: 1-benzyl-3-(4-methylsulfanylphenyl)urea
CAS Name: 1-[4-(methylthio)phenyl]-3-(phenylmethyl)urea
IUPAC NAME: 1-benzyl-3-(4-methylsulfanylphenyl)urea
SYSTEMATIC NAME: 1-(4-methylsulfanylphenyl)-3-(phenylmethyl)urea
MOLECULAR FORMULA: C15H16N2OS
MOLECULAR WEIGHT: 272.36534
SMILES: CSC1=CC=C(C=C1)NC(=O)NCC2=CC=CC=C2
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Product OPENEYE NAME: 1-benzyl-3-(3-chlorophenyl)-7H-purine-2,6-dione
CAS Name: 3-(3-chlorophenyl)-1-(phenylmethyl)-7H-purine-2,6-dione
IUPAC NAME: 1-benzyl-3-(3-chlorophenyl)-7H-purine-2,6-dione
SYSTEMATIC NAME: 3-(3-chlorophenyl)-1-(phenylmethyl)-7H-purine-2,6-dione
MOLECULAR FORMULA: C18H13ClN4O2
MOLECULAR WEIGHT: 352.77442
SMILES: C1=CC=C(C=C1)CN2C(=O)C3=C(N=CN3)N(C2=O)C4=CC(=CC=C4)Cl
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Product OPENEYE NAME: N-(benzylideneamino)-5-(trifluoromethoxy)-1H-indole-2-carboxamide
CAS Name: N-[(phenylmethylene)amino]-5-(trifluoromethoxy)-1H-indole-2-carboxamide
IUPAC NAME: N-(benzylideneamino)-5-(trifluoromethoxy)-1H-indole-2-carboxamide
SYSTEMATIC NAME: N-[(phenylmethylidene)amino]-5-(trifluoromethyloxy)-1H-indole-2-carboxamide
MOLECULAR FORMULA: C17H12F3N3O2
MOLECULAR WEIGHT: 347.29129
SMILES: C1=CC=C(C=C1)C=NNC(=O)C2=CC3=C(N2)C=CC(=C3)OC(F)(F)F
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Product OPENEYE NAME: N-[(4-chlorophenyl)methyleneamino]-5-(trifluoromethoxy)-1H-indole-2-carboxamide
CAS Name: N-[(4-chlorophenyl)methylideneamino]-5-(trifluoromethoxy)-1H-indole-2-carboxamide
IUPAC NAME: N-[(4-chlorophenyl)methylideneamino]-5-(trifluoromethoxy)-1H-indole-2-carboxamide
SYSTEMATIC NAME: N-[(4-chlorophenyl)methylideneamino]-5-(trifluoromethyloxy)-1H-indole-2-carboxamide
MOLECULAR FORMULA: C17H11ClF3N3O2
MOLECULAR WEIGHT: 381.73635
SMILES: C1=CC(=CC=C1C=NNC(=O)C2=CC3=C(N2)C=CC(=C3)OC(F)(F)F)Cl
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