Tuesday, December 27, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 4-[5-(4-benzylpiperidine-1-carbonyl)-1,2,4-oxadiazol-3-ylidene]-2,6-dichloro-cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[5-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-1,2,4-oxadiazol-3-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 4-[5-(4-benzylpiperidine-1-carbonyl)-1,2,4-oxadiazol-3-ylidene]-2,6-dichlorocyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C21H19Cl2N3O3
MOLECULAR WEIGHT: 432.29986
SMILES: C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=NC(=C4C=C(C(=O)C(=C4)Cl)Cl)NO3
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Product OPENEYE NAME: 2,6-dibromo-4-[5-[4-[hydroxy(diphenyl)methyl]piperidine-1-carbonyl]-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dibromo-4-[5-[[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]-oxomethyl]-1,2,4-oxadiazol-3-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dibromo-4-[5-[4-[hydroxy(diphenyl)methyl]piperidine-1-carbonyl]-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(bromanyl)-4-[5-[4-[oxidanyl(diphenyl)methyl]piperidin-1-yl]carbonyl-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C27H23Br2N3O4
MOLECULAR WEIGHT: 613.29722
SMILES: C1CN(CCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C(=O)C4=NC(=C5C=C(C(=O)C(=C5)Br)Br)NO4
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Product OPENEYE NAME: N-[[4-[4-chloro-3-(trifluoromethyl)phenoxy]phenyl]methyl]-3-(3,5-dichloro-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazole-5-carboxamide
CAS Name: N-[[4-[4-chloro-3-(trifluoromethyl)phenoxy]phenyl]methyl]-3-(3,5-dichloro-4-oxo-1-cyclohexa-2,5-dienylidene)-1,2,4-oxadiazole-5-carboxamide
IUPAC NAME: N-[[4-[4-chloro-3-(trifluoromethyl)phenoxy]phenyl]methyl]-3-(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazole-5-carboxamide
SYSTEMATIC NAME: 3-[3,5-bis(chloranyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-N-[[4-[4-chloranyl-3-(trifluoromethyl)phenoxy]phenyl]methyl]-1,2,4-oxadiazole-5-carboxamide
MOLECULAR FORMULA: C23H13Cl3F3N3O4
MOLECULAR WEIGHT: 558.72123
SMILES: C1=CC(=CC=C1CNC(=O)C2=NC(=C3C=C(C(=O)C(=C3)Cl)Cl)NO2)OC4=CC(=C(C=C4)Cl)C(F)(F)F
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Product OPENEYE NAME: 2-[3-(acetamidomethyl)phenoxy]-4-fluoro-6-(2-fluoro-4-iodo-anilino)benzamide
CAS Name: 2-[3-(acetamidomethyl)phenoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
IUPAC NAME: 2-[3-(acetamidomethyl)phenoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
SYSTEMATIC NAME: 2-[3-(acetamidomethyl)phenoxy]-4-fluoranyl-6-[(2-fluoranyl-4-iodanyl-phenyl)amino]benzamide
MOLECULAR FORMULA: C22H18F2IN3O3
MOLECULAR WEIGHT: 537.297896
SMILES: CC(=O)NCC1=CC(=CC=C1)OC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N
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Product OPENEYE NAME: 4-fluoro-2-(2-fluoro-4-iodo-anilino)-6-[3-[(1-methylpyrazol-4-yl)sulfonylamino]phenoxy]benzamide
CAS Name: 4-fluoro-2-(2-fluoro-4-iodoanilino)-6-[3-[(1-methyl-4-pyrazolyl)sulfonylamino]phenoxy]benzamide
IUPAC NAME: 4-fluoro-2-(2-fluoro-4-iodoanilino)-6-[3-[(1-methylpyrazol-4-yl)sulfonylamino]phenoxy]benzamide
SYSTEMATIC NAME: 4-fluoranyl-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]-6-[3-[(1-methylpyrazol-4-yl)sulfonylamino]phenoxy]benzamide
MOLECULAR FORMULA: C23H18F2IN5O4S
MOLECULAR WEIGHT: 625.386396
SMILES: CN1C=C(C=N1)S(=O)(=O)NC2=CC(=CC=C2)OC3=C(C(=CC(=C3)F)NC4=C(C=C(C=C4)I)F)C(=O)N
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Product OPENEYE NAME: 2-[3-(cyclopropanecarbonylamino)phenoxy]-4-fluoro-6-(2-fluoro-4-iodo-anilino)benzamide
CAS Name: 2-[3-[[cyclopropyl(oxo)methyl]amino]phenoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
IUPAC NAME: 2-[3-(cyclopropanecarbonylamino)phenoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)benzamide
SYSTEMATIC NAME: 2-[3-(cyclopropylcarbonylamino)phenoxy]-4-fluoranyl-6-[(2-fluoranyl-4-iodanyl-phenyl)amino]benzamide
MOLECULAR FORMULA: C23H18F2IN3O3
MOLECULAR WEIGHT: 549.308596
SMILES: C1CC1C(=O)NC2=CC(=CC=C2)OC3=C(C(=CC(=C3)F)NC4=C(C=C(C=C4)I)F)C(=O)N
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Product OPENEYE NAME: 4-fluoro-2-(2-fluoro-4-iodo-anilino)-6-[3-(methanesulfonamidomethyl)phenoxy]benzamide
CAS Name: 4-fluoro-2-(2-fluoro-4-iodoanilino)-6-[3-(methanesulfonamidomethyl)phenoxy]benzamide
IUPAC NAME: 4-fluoro-2-(2-fluoro-4-iodoanilino)-6-[3-(methanesulfonamidomethyl)phenoxy]benzamide
SYSTEMATIC NAME: 4-fluoranyl-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]-6-[3-(methylsulfonylaminomethyl)phenoxy]benzamide
MOLECULAR FORMULA: C21H18F2IN3O4S
MOLECULAR WEIGHT: 573.351596
SMILES: CS(=O)(=O)NCC1=CC(=CC=C1)OC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N
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Product OPENEYE NAME: N-[3-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodo-anilino)phenoxy]phenyl]isoxazole-5-carboxamide
CAS Name: N-[3-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodoanilino)phenoxy]phenyl]-5-isoxazolecarboxamide
IUPAC NAME: N-[3-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodoanilino)phenoxy]phenyl]-1,2-oxazole-5-carboxamide
SYSTEMATIC NAME: N-[3-[2-aminocarbonyl-5-fluoranyl-3-[(2-fluoranyl-4-iodanyl-phenyl)amino]phenoxy]phenyl]-1,2-oxazole-5-carboxamide
MOLECULAR FORMULA: C23H15F2IN4O4
MOLECULAR WEIGHT: 576.290876
SMILES: C1=CC(=CC(=C1)OC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N)NC(=O)C4=CC=NO4
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Product OPENEYE NAME: N-[3-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodo-anilino)phenoxy]phenyl]-1H-pyrazole-4-carboxamide
CAS Name: N-[3-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodoanilino)phenoxy]phenyl]-1H-pyrazole-4-carboxamide
IUPAC NAME: N-[3-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodoanilino)phenoxy]phenyl]-1H-pyrazole-4-carboxamide
SYSTEMATIC NAME: N-[3-[2-aminocarbonyl-5-fluoranyl-3-[(2-fluoranyl-4-iodanyl-phenyl)amino]phenoxy]phenyl]-1H-pyrazole-4-carboxamide
MOLECULAR FORMULA: C23H16F2IN5O3
MOLECULAR WEIGHT: 575.306116
SMILES: C1=CC(=CC(=C1)OC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N)NC(=O)C4=CNN=C4
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Product OPENEYE NAME: 2-[3-[5-[4-(cyclopentoxy)-2-hydroxy-benzoyl]-2-[(3-oxo-1,2-benzoxazol-6-yl)methoxy]phenyl]morpholin-4-yl]ethyl propanoate
CAS Name: propanoic acid 2-[3-[5-[(4-cyclopentyloxy-2-hydroxyphenyl)-oxomethyl]-2-[(3-oxo-1,2-benzoxazol-6-yl)methoxy]phenyl]-4-morpholinyl]ethyl ester
IUPAC NAME: 2-[3-[5-(4-cyclopentyloxy-2-hydroxybenzoyl)-2-[(3-oxo-1,2-benzoxazol-6-yl)methoxy]phenyl]morpholin-4-yl]ethyl propanoate
SYSTEMATIC NAME: 2-[3-[5-(4-cyclopentyloxy-2-oxidanyl-phenyl)carbonyl-2-[(3-oxidanylidene-1,2-benzoxazol-6-yl)methoxy]phenyl]morpholin-4-yl]ethyl propanoate
MOLECULAR FORMULA: C35H38N2O9
MOLECULAR WEIGHT: 630.68422
SMILES: CCC(=O)OCCN1CCOCC1C2=C(C=CC(=C2)C(=O)C3=C(C=C(C=C3)OC4CCCC4)O)OCC5=CC6=C(C=C5)C(=O)NO6
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Product OPENEYE NAME: 5-[(2S,3R)-1-(3-chloro-4-cyano-phenyl)-3-hydroxy-2-methyl-pyrrolidin-3-yl]-N-cyclopropyl-pyridine-2-carboxamide
CAS Name: 5-[(2S,3R)-1-(3-chloro-4-cyanophenyl)-3-hydroxy-2-methyl-3-pyrrolidinyl]-N-cyclopropyl-2-pyridinecarboxamide
IUPAC NAME: 5-[(2S,3R)-1-(3-chloro-4-cyanophenyl)-3-hydroxy-2-methylpyrrolidin-3-yl]-N-cyclopropylpyridine-2-carboxamide
SYSTEMATIC NAME: 5-[(2S,3R)-1-(3-chloranyl-4-cyano-phenyl)-2-methyl-3-oxidanyl-pyrrolidin-3-yl]-N-cyclopropyl-pyridine-2-carboxamide
MOLECULAR FORMULA: C21H21ClN4O2
MOLECULAR WEIGHT: 396.87004
SMILES: C[C@H]1[C@@](CCN1C2=CC(=C(C=C2)C#N)Cl)(C3=CN=C(C=C3)C(=O)NC4CC4)O
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Product OPENEYE NAME: 3-[(2S,3R)-1-(4-cyano-3-fluoro-phenyl)-3-hydroxy-2-methyl-pyrrolidin-3-yl]-1-methyl-2H-pyridine-6-carboxamide
CAS Name: 3-[(2S,3R)-1-(4-cyano-3-fluorophenyl)-3-hydroxy-2-methyl-3-pyrrolidinyl]-1-methyl-2H-pyridine-6-carboxamide
IUPAC NAME: 3-[(2S,3R)-1-(4-cyano-3-fluorophenyl)-3-hydroxy-2-methylpyrrolidin-3-yl]-1-methyl-2H-pyridine-6-carboxamide
SYSTEMATIC NAME: 3-[(2S,3R)-1-(4-cyano-3-fluoranyl-phenyl)-2-methyl-3-oxidanyl-pyrrolidin-3-yl]-1-methyl-2H-pyridine-6-carboxamide
MOLECULAR FORMULA: C19H21FN4O2
MOLECULAR WEIGHT: 356.394043
SMILES: C[C@H]1[C@@](CCN1C2=CC(=C(C=C2)C#N)F)(C3=CC=C(N(C3)C)C(=O)N)O
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