Wednesday, April 3, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazine-1,4-diium-1-yl]-N-[(2R)-2-phenylpropyl]acetamide
CAS Name: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazine-1,4-diiumyl]-N-[(2R)-2-phenylpropyl]acetamide
IUPAC NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazine-1,4-diium-1-yl]-N-[(2R)-2-phenylpropyl]acetamide
SYSTEMATIC NAME: 2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazine-1,4-diium-1-yl]-N-[(2R)-2-phenylpropyl]ethanamide
MOLECULAR FORMULA: C25H36N4O2+2
MOLECULAR WEIGHT: 424.57894
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC(=O)NC[C@H](C)C3=CC=CC=C3
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Product OPENEYE NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazin-1-yl]-N-[(2R)-2-phenylpropyl]acetamide
CAS Name: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazinyl]-N-[(2R)-2-phenylpropyl]acetamide
IUPAC NAME: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazin-1-yl]-N-[(2R)-2-phenylpropyl]acetamide
SYSTEMATIC NAME: 2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-N-[(2R)-2-phenylpropyl]ethanamide
MOLECULAR FORMULA: C25H34N4O2
MOLECULAR WEIGHT: 422.56306
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC(=O)NC[C@H](C)C3=CC=CC=C3
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Product OPENEYE NAME: 1-(4-bromophenyl)sulfonyl-4-(p-tolylmethyl)piperazin-4-ium
CAS Name: 1-(4-bromophenyl)sulfonyl-4-[(4-methylphenyl)methyl]piperazin-4-ium
IUPAC NAME: 1-(4-bromophenyl)sulfonyl-4-[(4-methylphenyl)methyl]piperazin-4-ium
SYSTEMATIC NAME: 1-(4-bromophenyl)sulfonyl-4-[(4-methylphenyl)methyl]piperazin-4-ium
MOLECULAR FORMULA: C18H22BrN2O2S+
MOLECULAR WEIGHT: 410.34848
SMILES: CC1=CC=C(C=C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br
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Product OPENEYE NAME: 1-(4-bromophenyl)sulfonyl-4-(p-tolylmethyl)piperazine
CAS Name: 1-(4-bromophenyl)sulfonyl-4-[(4-methylphenyl)methyl]piperazine
IUPAC NAME: 1-(4-bromophenyl)sulfonyl-4-[(4-methylphenyl)methyl]piperazine
SYSTEMATIC NAME: 1-(4-bromophenyl)sulfonyl-4-[(4-methylphenyl)methyl]piperazine
MOLECULAR FORMULA: C18H21BrN2O2S
MOLECULAR WEIGHT: 409.34054
SMILES: CC1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br
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Product OPENEYE NAME: 2-chloro-N-(4-fluorophenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide
CAS Name: 2-chloro-N-(4-fluorophenyl)-5-(1-pyrrolidinylsulfonyl)benzamide
IUPAC NAME: 2-chloro-N-(4-fluorophenyl)-5-pyrrolidin-1-ylsulfonylbenzamide
SYSTEMATIC NAME: 2-chloranyl-N-(4-fluorophenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide
MOLECULAR FORMULA: C17H16ClFN2O3S
MOLECULAR WEIGHT: 382.836943
SMILES: C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)F
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Product OPENEYE NAME: N-[2-[4-methoxy-3-(4-methoxyphenyl)anilino]-2-oxo-ethyl]benzamide
CAS Name: N-[2-[4-methoxy-3-(4-methoxyphenyl)anilino]-2-oxoethyl]benzamide
IUPAC NAME: N-[2-[4-methoxy-3-(4-methoxyphenyl)anilino]-2-oxoethyl]benzamide
SYSTEMATIC NAME: N-[2-[[4-methoxy-3-(4-methoxyphenyl)phenyl]amino]-2-oxidanylidene-ethyl]benzamide
MOLECULAR FORMULA: C23H22N2O4
MOLECULAR WEIGHT: 390.43178
SMILES: COC1=CC=C(C=C1)C2=C(C=CC(=C2)NC(=O)CNC(=O)C3=CC=CC=C3)OC
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Product OPENEYE NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1R)-1-methylpropyl]acetamide
CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[(2R)-butan-2-yl]acetamide
IUPAC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2R)-butan-2-yl]acetamide
SYSTEMATIC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2R)-butan-2-yl]ethanamide
MOLECULAR FORMULA: C16H25BrN3O3S+
MOLECULAR WEIGHT: 419.357
SMILES: CC[C@@H](C)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br
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Product OPENEYE NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[(1R)-1-methylpropyl]acetamide
CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-N-[(2R)-butan-2-yl]acetamide
IUPAC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[(2R)-butan-2-yl]acetamide
SYSTEMATIC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[(2R)-butan-2-yl]ethanamide
MOLECULAR FORMULA: C16H24BrN3O3S
MOLECULAR WEIGHT: 418.34906
SMILES: CC[C@@H](C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[[2-(2-thienyl)oxazol-4-yl]methyl]piperazine-1,4-diium-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(2-thiophen-2-yl-4-oxazolyl)methyl]-1-piperazine-1,4-diiumyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazine-1,4-diium-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide
MOLECULAR FORMULA: C22H28N4O2S+2
MOLECULAR WEIGHT: 412.54832
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC3=COC(=N3)C4=CC=CS4
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-[4-[[2-(2-thienyl)oxazol-4-yl]methyl]piperazin-1-yl]acetamide
CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(2-thiophen-2-yl-4-oxazolyl)methyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-[4-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-[4-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C22H26N4O2S
MOLECULAR WEIGHT: 410.53244
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC3=COC(=N3)C4=CC=CS4
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Product OPENEYE NAME: [2-(4-tert-butylanilino)-2-oxo-ethyl] (2S)-2-(butylsulfonylamino)propanoate
CAS Name: (2S)-2-(butylsulfonylamino)propanoic acid [2-(4-tert-butylanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(4-tert-butylanilino)-2-oxoethyl] (2S)-2-(butylsulfonylamino)propanoate
SYSTEMATIC NAME: [2-[(4-tert-butylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-(butylsulfonylamino)propanoate
MOLECULAR FORMULA: C19H30N2O5S
MOLECULAR WEIGHT: 398.5169
SMILES: CCCCS(=O)(=O)N[C@@H](C)C(=O)OCC(=O)NC1=CC=C(C=C1)C(C)(C)C
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Product OPENEYE NAME: [(1R)-1-methyl-2-[2-[(1R)-1-methylpropyl]anilino]-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2R)-1-[2-[(2R)-butan-2-yl]anilino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[2-[(2R)-butan-2-yl]anilino]-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-[[2-[(2R)-butan-2-yl]phenyl]amino]-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C23H25NO4
MOLECULAR WEIGHT: 379.4489
SMILES: CC[C@@H](C)C1=CC=CC=C1NC(=O)[C@@H](C)OC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1S)-1-methylpropyl]acetamide
CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[(2S)-butan-2-yl]acetamide
IUPAC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2S)-butan-2-yl]acetamide
SYSTEMATIC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2S)-butan-2-yl]ethanamide
MOLECULAR FORMULA: C16H25BrN3O3S+
MOLECULAR WEIGHT: 419.357
SMILES: CC[C@H](C)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br
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Product OPENEYE NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[(1S)-1-methylpropyl]acetamide
CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-N-[(2S)-butan-2-yl]acetamide
IUPAC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[(2S)-butan-2-yl]acetamide
SYSTEMATIC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[(2S)-butan-2-yl]ethanamide
MOLECULAR FORMULA: C16H24BrN3O3S
MOLECULAR WEIGHT: 418.34906
SMILES: CC[C@H](C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br
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Product OPENEYE NAME: (E)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-N-(4-fluorophenyl)prop-2-enamide
CAS Name: (E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-N-(4-fluorophenyl)-2-propenamide
IUPAC NAME: (E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(4-fluorophenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(4-fluorophenyl)prop-2-enamide
MOLECULAR FORMULA: C17H19ClFN3O
MOLECULAR WEIGHT: 335.803663
SMILES: CC1=NN(C(=C1/C=C/C(=O)NC2=CC=C(C=C2)F)Cl)CC(C)C
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Product OPENEYE NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-diethyl-acetamide
CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazin-1-iumyl]-N,N-diethylacetamide
IUPAC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-diethylacetamide
SYSTEMATIC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-diethyl-ethanamide
MOLECULAR FORMULA: C16H25BrN3O3S+
MOLECULAR WEIGHT: 419.357
SMILES: CCN(CC)C(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br
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Product OPENEYE NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N,N-diethyl-acetamide
CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-N,N-diethylacetamide
IUPAC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N,N-diethylacetamide
SYSTEMATIC NAME: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N,N-diethyl-ethanamide
MOLECULAR FORMULA: C16H24BrN3O3S
MOLECULAR WEIGHT: 418.34906
SMILES: CCN(CC)C(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br
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Product OPENEYE NAME: (3R,7aS)-N-(4-fluorophenyl)-5-oxo-7a-phenyl-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
CAS Name: (3R,7aS)-N-(4-fluorophenyl)-5-oxo-7a-phenyl-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide
IUPAC NAME: (3R,7aS)-N-(4-fluorophenyl)-5-oxo-7a-phenyl-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
SYSTEMATIC NAME: (3R,7aS)-N-(4-fluorophenyl)-5-oxidanylidene-7a-phenyl-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
MOLECULAR FORMULA: C19H17FN2O2S
MOLECULAR WEIGHT: 356.413883
SMILES: C1C[C@@]2(N(C1=O)[C@@H](CS2)C(=O)NC3=CC=C(C=C3)F)C4=CC=CC=C4
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Product OPENEYE NAME: 4-fluoro-N-[4-methoxy-3-(4-methoxyphenyl)phenyl]benzamide
CAS Name: 4-fluoro-N-[4-methoxy-3-(4-methoxyphenyl)phenyl]benzamide
IUPAC NAME: 4-fluoro-N-[4-methoxy-3-(4-methoxyphenyl)phenyl]benzamide
SYSTEMATIC NAME: 4-fluoranyl-N-[4-methoxy-3-(4-methoxyphenyl)phenyl]benzamide
MOLECULAR FORMULA: C21H18FNO3
MOLECULAR WEIGHT: 351.370923
SMILES: COC1=CC=C(C=C1)C2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)F)OC
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