Sunday, May 5, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [(2S)-2-ethyl-1-piperidyl]-[1-(2-thienylsulfonyl)-4-piperidyl]methanone
CAS Name: [(2S)-2-ethyl-1-piperidinyl]-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methanone
IUPAC NAME: [(2S)-2-ethylpiperidin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone
SYSTEMATIC NAME: [(2S)-2-ethylpiperidin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone
MOLECULAR FORMULA: C17H26N2O3S2
MOLECULAR WEIGHT: 370.52994
SMILES: CC[C@H]1CCCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3
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Product OPENEYE NAME: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2H-benzotriazole-5-carboxamide
CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2H-benzotriazole-5-carboxamide
IUPAC NAME: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2H-benzotriazole-5-carboxamide
SYSTEMATIC NAME: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2H-benzotriazole-5-carboxamide
MOLECULAR FORMULA: C20H13N5OS
MOLECULAR WEIGHT: 371.41512
SMILES: C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=O)C4=CC5=NNN=C5C=C4
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Product OPENEYE NAME: [4-(methylcarbamoyl)phenyl] 2-(trifluoromethyl)benzoate
CAS Name: 2-(trifluoromethyl)benzoic acid [4-(methylcarbamoyl)phenyl] ester
IUPAC NAME: [4-(methylcarbamoyl)phenyl] 2-(trifluoromethyl)benzoate
SYSTEMATIC NAME: [4-(methylcarbamoyl)phenyl] 2-(trifluoromethyl)benzoate
MOLECULAR FORMULA: C16H12F3NO3
MOLECULAR WEIGHT: 323.26659
SMILES: CNC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2C(F)(F)F
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Product OPENEYE NAME: N-cyclopropyl-2-[[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoyl]amino]benzamide
CAS Name: N-cyclopropyl-2-[[[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]-oxomethyl]amino]benzamide
IUPAC NAME: N-cyclopropyl-2-[[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoyl]amino]benzamide
SYSTEMATIC NAME: N-cyclopropyl-2-[[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]carbonylamino]benzamide
MOLECULAR FORMULA: C21H20N4O4
MOLECULAR WEIGHT: 392.4079
SMILES: CC1=NC(=NO1)COC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NC4CC4
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Product OPENEYE NAME: N-[4-[3-(1,3-benzothiazol-2-yl)anilino]-4-oxo-butyl]furan-2-carboxamide
CAS Name: N-[4-[3-(1,3-benzothiazol-2-yl)anilino]-4-oxobutyl]-2-furancarboxamide
IUPAC NAME: N-[4-[3-(1,3-benzothiazol-2-yl)anilino]-4-oxobutyl]furan-2-carboxamide
SYSTEMATIC NAME: N-[4-[[3-(1,3-benzothiazol-2-yl)phenyl]amino]-4-oxidanylidene-butyl]furan-2-carboxamide
MOLECULAR FORMULA: C22H19N3O3S
MOLECULAR WEIGHT: 405.46956
SMILES: C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=O)CCCNC(=O)C4=CC=CO4
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Product OPENEYE NAME: [(2R)-2-ethyl-1-piperidyl]-(4-methoxy-3-morpholinosulfonyl-phenyl)methanone
CAS Name: [(2R)-2-ethyl-1-piperidinyl]-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]methanone
IUPAC NAME: [(2R)-2-ethylpiperidin-1-yl]-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)methanone
SYSTEMATIC NAME: [(2R)-2-ethylpiperidin-1-yl]-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)methanone
MOLECULAR FORMULA: C19H28N2O5S
MOLECULAR WEIGHT: 396.50102
SMILES: CC[C@@H]1CCCCN1C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3
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Product OPENEYE NAME: [(2S)-2-ethyl-1-piperidyl]-(4-methoxy-3-morpholinosulfonyl-phenyl)methanone
CAS Name: [(2S)-2-ethyl-1-piperidinyl]-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]methanone
IUPAC NAME: [(2S)-2-ethylpiperidin-1-yl]-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)methanone
SYSTEMATIC NAME: [(2S)-2-ethylpiperidin-1-yl]-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)methanone
MOLECULAR FORMULA: C19H28N2O5S
MOLECULAR WEIGHT: 396.50102
SMILES: CC[C@H]1CCCCN1C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3
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Product OPENEYE NAME: N-cyclopropyl-2-[[3-(2,2-dimethylpropanoylamino)benzoyl]amino]benzamide
CAS Name: N-cyclopropyl-2-[[[3-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-oxomethyl]amino]benzamide
IUPAC NAME: N-cyclopropyl-2-[[3-(2,2-dimethylpropanoylamino)benzoyl]amino]benzamide
SYSTEMATIC NAME: N-cyclopropyl-2-[[3-(2,2-dimethylpropanoylamino)phenyl]carbonylamino]benzamide
MOLECULAR FORMULA: C22H25N3O3
MOLECULAR WEIGHT: 379.4522
SMILES: CC(C)(C)C(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)NC3CC3
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Product OPENEYE NAME: N-[2-(cyclopropylcarbamoyl)phenyl]-1,5-dimethyl-pyrazole-4-carboxamide
CAS Name: N-[2-[(cyclopropylamino)-oxomethyl]phenyl]-1,5-dimethyl-4-pyrazolecarboxamide
IUPAC NAME: N-[2-(cyclopropylcarbamoyl)phenyl]-1,5-dimethylpyrazole-4-carboxamide
SYSTEMATIC NAME: N-[2-(cyclopropylcarbamoyl)phenyl]-1,5-dimethyl-pyrazole-4-carboxamide
MOLECULAR FORMULA: C16H18N4O2
MOLECULAR WEIGHT: 298.33972
SMILES: CC1=C(C=NN1C)C(=O)NC2=CC=CC=C2C(=O)NC3CC3
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Product OPENEYE NAME: N-[2-(cyclopropylcarbamoyl)phenyl]-1-(2-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxamide
CAS Name: N-[2-[(cyclopropylamino)-oxomethyl]phenyl]-1-(2-fluorophenyl)-2,5-dimethyl-3-pyrrolecarboxamide
IUPAC NAME: N-[2-(cyclopropylcarbamoyl)phenyl]-1-(2-fluorophenyl)-2,5-dimethylpyrrole-3-carboxamide
SYSTEMATIC NAME: N-[2-(cyclopropylcarbamoyl)phenyl]-1-(2-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxamide
MOLECULAR FORMULA: C23H22FN3O2
MOLECULAR WEIGHT: 391.438083
SMILES: CC1=CC(=C(N1C2=CC=CC=C2F)C)C(=O)NC3=CC=CC=C3C(=O)NC4CC4
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Product OPENEYE NAME: (3S)-N-benzyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-pyrrolidine-3-carboxamide
CAS Name: (3S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-(phenylmethyl)-3-pyrrolidinecarboxamide
IUPAC NAME: (3S)-N-benzyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxamide
SYSTEMATIC NAME: (3S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-N-(phenylmethyl)pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C22H26N2O4
MOLECULAR WEIGHT: 382.45284
SMILES: COC1=C(C=C(C=C1)CCN2C[C@H](CC2=O)C(=O)NCC3=CC=CC=C3)OC
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