Tuesday, December 27, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 2-[7-[3-[(1R,5S)-3-azabicyclo[3.2.1]octan-3-yl]propoxy]-3-(3-chlorophenyl)-1-oxo-pyrrolo[1,2-a]pyrazin-2-yl]-N-isopropyl-acetamide
CAS Name: 2-[7-[3-[(1R,5S)-3-azabicyclo[3.2.1]octan-3-yl]propoxy]-3-(3-chlorophenyl)-1-oxo-2-pyrrolo[1,2-a]pyrazinyl]-N-propan-2-ylacetamide
IUPAC NAME: 2-[7-[3-[(1R,5S)-3-azabicyclo[3.2.1]octan-3-yl]propoxy]-3-(3-chlorophenyl)-1-oxopyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide
SYSTEMATIC NAME: 2-[7-[3-[(1R,5S)-3-azabicyclo[3.2.1]octan-3-yl]propoxy]-3-(3-chlorophenyl)-1-oxidanylidene-pyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C28H35ClN4O3
MOLECULAR WEIGHT: 511.0555
SMILES: CC(C)NC(=O)CN1C(=CN2C=C(C=C2C1=O)OCCCN3C[C@@H]4CC[C@@H](C4)C3)C5=CC(=CC=C5)Cl
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Product OPENEYE NAME: 2-[3-(3-chlorophenyl)-7-[3-(3-fluoro-1-piperidyl)propoxy]-1-oxo-pyrrolo[1,2-a]pyrazin-2-yl]-N-isopropyl-acetamide
CAS Name: 2-[3-(3-chlorophenyl)-7-[3-(3-fluoro-1-piperidinyl)propoxy]-1-oxo-2-pyrrolo[1,2-a]pyrazinyl]-N-propan-2-ylacetamide
IUPAC NAME: 2-[3-(3-chlorophenyl)-7-[3-(3-fluoropiperidin-1-yl)propoxy]-1-oxopyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide
SYSTEMATIC NAME: 2-[3-(3-chlorophenyl)-7-[3-(3-fluoranylpiperidin-1-yl)propoxy]-1-oxidanylidene-pyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C26H32ClFN4O3
MOLECULAR WEIGHT: 503.008683
SMILES: CC(C)NC(=O)CN1C(=CN2C=C(C=C2C1=O)OCCCN3CCCC(C3)F)C4=CC(=CC=C4)Cl
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Product OPENEYE NAME: 2-[7-[3-[(8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]propoxy]-3-(3-chlorophenyl)-1-oxo-pyrrolo[1,2-a]pyrazin-2-yl]-N-isopropyl-acetamide
CAS Name: 2-[7-[3-[(8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]propoxy]-3-(3-chlorophenyl)-1-oxo-2-pyrrolo[1,2-a]pyrazinyl]-N-propan-2-ylacetamide
IUPAC NAME: 2-[7-[3-[(8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]propoxy]-3-(3-chlorophenyl)-1-oxopyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide
SYSTEMATIC NAME: 2-[7-[3-[(8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]propoxy]-3-(3-chlorophenyl)-1-oxidanylidene-pyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C28H36ClN5O3
MOLECULAR WEIGHT: 526.07014
SMILES: CC(C)NC(=O)CN1C(=CN2C=C(C=C2C1=O)OCCCN3CCN4CCC[C@H]4C3)C5=CC(=CC=C5)Cl
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Product OPENEYE NAME: 2-[7-[[(1R,6S)-4-azabicyclo[4.1.0]heptan-6-yl]methoxy]-3-[4-fluoro-3-(trifluoromethyl)phenyl]-1-oxo-pyrrolo[1,2-a]pyrazin-2-yl]-N-isopropyl-acetamide
CAS Name: 2-[7-[[(1R,6S)-4-azabicyclo[4.1.0]heptan-6-yl]methoxy]-3-[4-fluoro-3-(trifluoromethyl)phenyl]-1-oxo-2-pyrrolo[1,2-a]pyrazinyl]-N-propan-2-ylacetamide
IUPAC NAME: 2-[7-[[(1R,6S)-4-azabicyclo[4.1.0]heptan-6-yl]methoxy]-3-[4-fluoro-3-(trifluoromethyl)phenyl]-1-oxopyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide
SYSTEMATIC NAME: 2-[7-[[(1R,6S)-4-azabicyclo[4.1.0]heptan-6-yl]methoxy]-3-[4-fluoranyl-3-(trifluoromethyl)phenyl]-1-oxidanylidene-pyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C26H28F4N4O3
MOLECULAR WEIGHT: 520.519133
SMILES: CC(C)NC(=O)CN1C(=CN2C=C(C=C2C1=O)OC[C@@]34C[C@@H]3CCNC4)C5=CC(=C(C=C5)F)C(F)(F)F
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Product OPENEYE NAME: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea; methanesulfonic acid
CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methoxy]phenyl]urea; methanesulfonic acid
IUPAC NAME: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea; methanesulfonic acid
SYSTEMATIC NAME: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea; methanesulfonic acid
MOLECULAR FORMULA: C25H20F6N4O6S
MOLECULAR WEIGHT: 618.504919
SMILES: CS(=O)(=O)O.C1=CC2=NC(=CC(=O)N2C=C1)COC3=CC=C(C=C3)NC(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea
CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methoxy]phenyl]urea
IUPAC NAME: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea
SYSTEMATIC NAME: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea
MOLECULAR FORMULA: C24H16F6N4O3
MOLECULAR WEIGHT: 522.399259
SMILES: C1=CC2=NC(=CC(=O)N2C=C1)COC3=CC=C(C=C3)NC(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: methanesulfonic acid; 1-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]urea
CAS Name: methanesulfonic acid; 1-[4-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]urea
IUPAC NAME: methanesulfonic acid; 1-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]urea
SYSTEMATIC NAME: methanesulfonic acid; 1-[4-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]urea
MOLECULAR FORMULA: C24H21F3N4O6S
MOLECULAR WEIGHT: 550.50695
SMILES: CS(=O)(=O)O.C1=CC2=NC(=CC(=O)N2C=C1)COC3=CC=C(C=C3)NC(=O)NC4=CC=C(C=C4)C(F)(F)F
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Product OPENEYE NAME: 1-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]urea
CAS Name: 1-[4-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]urea
IUPAC NAME: 1-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]urea
SYSTEMATIC NAME: 1-[4-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]urea
MOLECULAR FORMULA: C23H17F3N4O3
MOLECULAR WEIGHT: 454.40129
SMILES: C1=CC2=NC(=CC(=O)N2C=C1)COC3=CC=C(C=C3)NC(=O)NC4=CC=C(C=C4)C(F)(F)F
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Product OPENEYE NAME: 1-(3,5-difluorophenyl)-3-[4-[(8-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea; methanesulfonic acid
CAS Name: 1-(3,5-difluorophenyl)-3-[4-[(8-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methoxy]phenyl]urea; methanesulfonic acid
IUPAC NAME: 1-(3,5-difluorophenyl)-3-[4-[(8-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea; methanesulfonic acid
SYSTEMATIC NAME: 1-[3,5-bis(fluoranyl)phenyl]-3-[4-[(8-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea; methanesulfonic acid
MOLECULAR FORMULA: C24H22F2N4O6S
MOLECULAR WEIGHT: 532.516486
SMILES: CC1=CC2=NC(=CC(=O)N2C=C1)COC3=CC=C(C=C3)NC(=O)NC4=CC(=CC(=C4)F)F.CS(=O)(=O)O
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Product OPENEYE NAME: 1-(3,5-difluorophenyl)-3-[4-[(8-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea
CAS Name: 1-(3,5-difluorophenyl)-3-[4-[(8-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methoxy]phenyl]urea
IUPAC NAME: 1-(3,5-difluorophenyl)-3-[4-[(8-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea
SYSTEMATIC NAME: 1-[3,5-bis(fluoranyl)phenyl]-3-[4-[(8-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea
MOLECULAR FORMULA: C23H18F2N4O3
MOLECULAR WEIGHT: 436.410826
SMILES: CC1=CC2=NC(=CC(=O)N2C=C1)COC3=CC=C(C=C3)NC(=O)NC4=CC(=CC(=C4)F)F
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Product OPENEYE NAME: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea; methanesulfonic acid
CAS Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[4-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methoxy]phenyl]urea; methanesulfonic acid
IUPAC NAME: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea; methanesulfonic acid
SYSTEMATIC NAME: 1-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-[4-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea; methanesulfonic acid
MOLECULAR FORMULA: C24H20ClF3N4O6S
MOLECULAR WEIGHT: 584.95201
SMILES: CS(=O)(=O)O.C1=CC2=NC(=CC(=O)N2C=C1)COC3=CC=C(C=C3)NC(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl
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Product OPENEYE NAME: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea
CAS Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[4-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methoxy]phenyl]urea
IUPAC NAME: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea
SYSTEMATIC NAME: 1-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-[4-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]urea
MOLECULAR FORMULA: C23H16ClF3N4O3
MOLECULAR WEIGHT: 488.84635
SMILES: C1=CC2=NC(=CC(=O)N2C=C1)COC3=CC=C(C=C3)NC(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl
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Product OPENEYE NAME: methanesulfonic acid; 1-[4-[(8-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[3-(trifluoromethyl)phenyl]urea
CAS Name: methanesulfonic acid; 1-[4-[(8-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methoxy]phenyl]-3-[3-(trifluoromethyl)phenyl]urea
IUPAC NAME: methanesulfonic acid; 1-[4-[(8-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[3-(trifluoromethyl)phenyl]urea
SYSTEMATIC NAME: methanesulfonic acid; 1-[4-[(8-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[3-(trifluoromethyl)phenyl]urea
MOLECULAR FORMULA: C25H23F3N4O6S
MOLECULAR WEIGHT: 564.53353
SMILES: CC1=CC2=NC(=CC(=O)N2C=C1)COC3=CC=C(C=C3)NC(=O)NC4=CC=CC(=C4)C(F)(F)F.CS(=O)(=O)O
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Product OPENEYE NAME: 1-[4-[(8-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[3-(trifluoromethyl)phenyl]urea
CAS Name: 1-[4-[(8-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methoxy]phenyl]-3-[3-(trifluoromethyl)phenyl]urea
IUPAC NAME: 1-[4-[(8-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[3-(trifluoromethyl)phenyl]urea
SYSTEMATIC NAME: 1-[4-[(8-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]-3-[3-(trifluoromethyl)phenyl]urea
MOLECULAR FORMULA: C24H19F3N4O3
MOLECULAR WEIGHT: 468.42787
SMILES: CC1=CC2=NC(=CC(=O)N2C=C1)COC3=CC=C(C=C3)NC(=O)NC4=CC=CC(=C4)C(F)(F)F
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Product OPENEYE NAME: N-[(2R)-2-[4-[4-[(1R)-2-(isopropylsulfonylamino)-1-methyl-ethyl]phenyl]phenyl]propyl]propane-2-sulfonamide
CAS Name: N-[(2R)-2-[4-[4-[(2R)-1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]phenyl]propyl]-2-propanesulfonamide
IUPAC NAME: N-[(2R)-2-[4-[4-[(2R)-1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]phenyl]propyl]propane-2-sulfonamide
SYSTEMATIC NAME: N-[(2R)-2-[4-[4-[(2R)-1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]phenyl]propyl]propane-2-sulfonamide
MOLECULAR FORMULA: C24H36N2O4S2
MOLECULAR WEIGHT: 480.68364
SMILES: C[C@@H](CNS(=O)(=O)C(C)C)C1=CC=C(C=C1)C2=CC=C(C=C2)[C@@H](C)CNS(=O)(=O)C(C)C
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Product OPENEYE NAME: N-[(2S)-2-[4-[4-[(1S)-2-(isopropylsulfonylamino)-1-methyl-ethyl]phenyl]phenyl]propyl]propane-2-sulfonamide
CAS Name: N-[(2S)-2-[4-[4-[(2S)-1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]phenyl]propyl]-2-propanesulfonamide
IUPAC NAME: N-[(2S)-2-[4-[4-[(2S)-1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]phenyl]propyl]propane-2-sulfonamide
SYSTEMATIC NAME: N-[(2S)-2-[4-[4-[(2S)-1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]phenyl]propyl]propane-2-sulfonamide
MOLECULAR FORMULA: C24H36N2O4S2
MOLECULAR WEIGHT: 480.68364
SMILES: C[C@H](CNS(=O)(=O)C(C)C)C1=CC=C(C=C1)C2=CC=C(C=C2)[C@H](C)CNS(=O)(=O)C(C)C
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