Wednesday, March 28, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 4-benzhydryl-N-(3,5-dimethylphenyl)piperazine-1-carbothioamide
CAS Name: N-(3,5-dimethylphenyl)-4-(diphenylmethyl)-1-piperazinecarbothioamide
IUPAC NAME: 4-benzhydryl-N-(3,5-dimethylphenyl)piperazine-1-carbothioamide
SYSTEMATIC NAME: N-(3,5-dimethylphenyl)-4-(diphenylmethyl)piperazine-1-carbothioamide
MOLECULAR FORMULA: C26H29N3S
MOLECULAR WEIGHT: 415.59356
SMILES: CC1=CC(=CC(=C1)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C
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Product OPENEYE NAME: N-(2,4-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
CAS Name: N-(2,4-dimethylphenyl)-4-(4-methoxyphenyl)-1-piperazinecarbothioamide
IUPAC NAME: N-(2,4-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
SYSTEMATIC NAME: N-(2,4-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
MOLECULAR FORMULA: C20H25N3OS
MOLECULAR WEIGHT: 355.497
SMILES: CC1=CC(=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)OC)C
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Product OPENEYE NAME: N-(2-methoxyphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
CAS Name: N-(2-methoxyphenyl)-4-(4-methoxyphenyl)-1-piperazinecarbothioamide
IUPAC NAME: N-(2-methoxyphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
SYSTEMATIC NAME: N-(2-methoxyphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
MOLECULAR FORMULA: C19H23N3O2S
MOLECULAR WEIGHT: 357.46982
SMILES: COC1=CC=C(C=C1)N2CCN(CC2)C(=S)NC3=CC=CC=C3OC
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Product OPENEYE NAME: N-(3,5-dimethylphenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide
CAS Name: N-(3,5-dimethylphenyl)-4-(3-methoxyphenyl)-1-piperazinecarbothioamide
IUPAC NAME: N-(3,5-dimethylphenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide
SYSTEMATIC NAME: N-(3,5-dimethylphenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide
MOLECULAR FORMULA: C20H25N3OS
MOLECULAR WEIGHT: 355.497
SMILES: CC1=CC(=CC(=C1)NC(=S)N2CCN(CC2)C3=CC(=CC=C3)OC)C
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Product OPENEYE NAME: N-(2,3-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
CAS Name: N-(2,3-dimethylphenyl)-4-(4-methoxyphenyl)-1-piperazinecarbothioamide
IUPAC NAME: N-(2,3-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
SYSTEMATIC NAME: N-(2,3-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
MOLECULAR FORMULA: C20H25N3OS
MOLECULAR WEIGHT: 355.497
SMILES: CC1=C(C(=CC=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)OC)C
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Product OPENEYE NAME: N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
CAS Name: N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)-1-piperazinecarbothioamide
IUPAC NAME: N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
SYSTEMATIC NAME: N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
MOLECULAR FORMULA: C20H25N3OS
MOLECULAR WEIGHT: 355.497
SMILES: CC1=CC(=CC(=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)OC)C
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Product OPENEYE NAME: 4-benzhydryl-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide
CAS Name: N-(2,5-dimethylphenyl)-4-(diphenylmethyl)-1-piperazinecarbothioamide
IUPAC NAME: 4-benzhydryl-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide
SYSTEMATIC NAME: N-(2,5-dimethylphenyl)-4-(diphenylmethyl)piperazine-1-carbothioamide
MOLECULAR FORMULA: C26H29N3S
MOLECULAR WEIGHT: 415.59356
SMILES: CC1=CC(=C(C=C1)C)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 4-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
CAS Name: 4-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]-2,1,3-benzoxadiazole
IUPAC NAME: 4-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C16H15FN4O3S
MOLECULAR WEIGHT: 362.378703
SMILES: C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=NON=C43
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Product OPENEYE NAME: N-(2-benzoylphenyl)-3-methyl-benzofuran-2-carboxamide
CAS Name: N-(2-benzoylphenyl)-3-methyl-2-benzofurancarboxamide
IUPAC NAME: N-(2-benzoylphenyl)-3-methyl-1-benzofuran-2-carboxamide
SYSTEMATIC NAME: 3-methyl-N-[2-(phenylcarbonyl)phenyl]-1-benzofuran-2-carboxamide
MOLECULAR FORMULA: C23H17NO3
MOLECULAR WEIGHT: 355.38598
SMILES: CC1=C(OC2=CC=CC=C12)C(=O)NC3=CC=CC=C3C(=O)C4=CC=CC=C4
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Product OPENEYE NAME: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
CAS Name: 4-[[4-(2,5-dimethylphenyl)-1-piperazinyl]sulfonyl]-2,1,3-benzoxadiazole
IUPAC NAME: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C18H20N4O3S
MOLECULAR WEIGHT: 372.4414
SMILES: CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NON=C43
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Product OPENEYE NAME: [4-(2,1,3-benzoxadiazol-4-ylsulfonyl)piperazin-1-yl]-(2-furyl)methanone
CAS Name: [4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1-piperazinyl]-(2-furanyl)methanone
IUPAC NAME: [4-(2,1,3-benzoxadiazol-4-ylsulfonyl)piperazin-1-yl]-(furan-2-yl)methanone
SYSTEMATIC NAME: [4-(2,1,3-benzoxadiazol-4-ylsulfonyl)piperazin-1-yl]-(furan-2-yl)methanone
MOLECULAR FORMULA: C15H14N4O5S
MOLECULAR WEIGHT: 362.36046
SMILES: C1CN(CCN1C(=O)C2=CC=CO2)S(=O)(=O)C3=CC=CC4=NON=C43
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Product OPENEYE NAME: 4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
CAS Name: 4-[[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]-2,1,3-benzoxadiazole
IUPAC NAME: 4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C17H15F3N4O3S
MOLECULAR WEIGHT: 412.38621
SMILES: C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=CC=CC4=NON=C43
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Product OPENEYE NAME: 4-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
CAS Name: 4-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]-2,1,3-benzoxadiazole
IUPAC NAME: 4-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C16H15FN4O3S
MOLECULAR WEIGHT: 362.378703
SMILES: C1CN(CCN1C2=CC=CC=C2F)S(=O)(=O)C3=CC=CC4=NON=C43
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Product OPENEYE NAME: 4-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
CAS Name: 4-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]sulfonyl]-2,1,3-benzoxadiazole
IUPAC NAME: 4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C17H17ClN4O3S
MOLECULAR WEIGHT: 392.85988
SMILES: CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NON=C43
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Product OPENEYE NAME: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
CAS Name: 4-[[4-(2,3-dimethylphenyl)-1-piperazinyl]sulfonyl]-2,1,3-benzoxadiazole
IUPAC NAME: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C18H20N4O3S
MOLECULAR WEIGHT: 372.4414
SMILES: CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NON=C43)C
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Product OPENEYE NAME: 4-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
CAS Name: 4-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]-2,1,3-benzoxadiazole
IUPAC NAME: 4-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C17H18N4O4S
MOLECULAR WEIGHT: 374.41422
SMILES: COC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NON=C43
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Product OPENEYE NAME: 4-(4-cyclohexylpiperazin-1-yl)sulfonyl-2,1,3-benzoxadiazole
CAS Name: 4-[(4-cyclohexyl-1-piperazinyl)sulfonyl]-2,1,3-benzoxadiazole
IUPAC NAME: 4-(4-cyclohexylpiperazin-1-yl)sulfonyl-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-(4-cyclohexylpiperazin-1-yl)sulfonyl-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C16H22N4O3S
MOLECULAR WEIGHT: 350.43588
SMILES: C1CCC(CC1)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NON=C43
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Product OPENEYE NAME: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylbenzoic acid
CAS Name: 3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl]benzoic acid
IUPAC NAME: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylbenzoic acid
SYSTEMATIC NAME: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylbenzoic acid
MOLECULAR FORMULA: C19H20N2O6S
MOLECULAR WEIGHT: 404.4369
SMILES: C1CN(CCN1CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC(=C4)C(=O)O
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Product OPENEYE NAME: methyl 4-[5-[2-(3,4-dimethylanilino)-2-oxo-ethyl]sulfanyltetrazol-1-yl]benzoate
CAS Name: 4-[5-[[2-(3,4-dimethylanilino)-2-oxoethyl]thio]-1-tetrazolyl]benzoic acid methyl ester
IUPAC NAME: methyl 4-[5-[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzoate
SYSTEMATIC NAME: methyl 4-[5-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,3,4-tetrazol-1-yl]benzoate
MOLECULAR FORMULA: C19H19N5O3S
MOLECULAR WEIGHT: 397.45086
SMILES: CC1=C(C=C(C=C1)NC(=O)CSC2=NN=NN2C3=CC=C(C=C3)C(=O)OC)C
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Product OPENEYE NAME: (6S)-2-(4-methoxyphenyl)imino-3-methyl-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide
CAS Name: (6S)-2-(4-methoxyphenyl)imino-3-methyl-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide
IUPAC NAME: (6S)-2-(4-methoxyphenyl)imino-3-methyl-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide
SYSTEMATIC NAME: (6S)-2-(4-methoxyphenyl)imino-3-methyl-4-oxidanylidene-N-phenyl-1,3-thiazinane-6-carboxamide
MOLECULAR FORMULA: C19H19N3O3S
MOLECULAR WEIGHT: 369.43746
SMILES: CN1C(=O)C[C@H](SC1=NC2=CC=C(C=C2)OC)C(=O)NC3=CC=CC=C3
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Product OPENEYE NAME: (6R)-2-(4-methoxyphenyl)imino-3-methyl-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide
CAS Name: (6R)-2-(4-methoxyphenyl)imino-3-methyl-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide
IUPAC NAME: (6R)-2-(4-methoxyphenyl)imino-3-methyl-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide
SYSTEMATIC NAME: (6R)-2-(4-methoxyphenyl)imino-3-methyl-4-oxidanylidene-N-phenyl-1,3-thiazinane-6-carboxamide
MOLECULAR FORMULA: C19H19N3O3S
MOLECULAR WEIGHT: 369.43746
SMILES: CN1C(=O)C[C@@H](SC1=NC2=CC=C(C=C2)OC)C(=O)NC3=CC=CC=C3
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