Friday, December 30, 2011

All Chemical Compounds Information



Product OPENEYE NAME: cyclohexyl 2-(1-tert-butoxycarbonyl-4-piperidyl)thiazole-4-carboxylate
CAS Name: 2-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinyl]-4-thiazolecarboxylic acid cyclohexyl ester
IUPAC NAME: cyclohexyl 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-1,3-thiazole-4-carboxylate
SYSTEMATIC NAME: cyclohexyl 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-1,3-thiazole-4-carboxylate
MOLECULAR FORMULA: C20H30N2O4S
MOLECULAR WEIGHT: 394.5282
SMILES: CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)OC3CCCCC3
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Product OPENEYE NAME: (2R)-N-[(1S)-2-[(6-amino-3-pyridyl)methylamino]-1-[(3,4-difluorophenyl)methyl]-2-oxo-ethyl]-2-(dimethylamino)-3,3-dimethyl-butanamide
CAS Name: (2R)-N-[(2S)-1-[(6-amino-3-pyridinyl)methylamino]-3-(3,4-difluorophenyl)-1-oxopropan-2-yl]-2-(dimethylamino)-3,3-dimethylbutanamide
IUPAC NAME: (2R)-N-[(2S)-1-[(6-aminopyridin-3-yl)methylamino]-3-(3,4-difluorophenyl)-1-oxopropan-2-yl]-2-(dimethylamino)-3,3-dimethylbutanamide
SYSTEMATIC NAME: (2R)-N-[(2S)-1-[(6-azanylpyridin-3-yl)methylamino]-3-[3,4-bis(fluoranyl)phenyl]-1-oxidanylidene-propan-2-yl]-2-(dimethylamino)-3,3-dimethyl-butanamide
MOLECULAR FORMULA: C23H31F2N5O2
MOLECULAR WEIGHT: 447.521346
SMILES: CC(C)(C)[C@H](C(=O)N[C@@H](CC1=CC(=C(C=C1)F)F)C(=O)NCC2=CN=C(C=C2)N)N(C)C
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Product OPENEYE NAME: (2R)-N-[(1S)-2-[(6-amino-2-methyl-3-pyridyl)methylamino]-1-[(4-fluorophenyl)methyl]-2-oxo-ethyl]-1-methyl-pyrrolidine-2-carboxamide
CAS Name: (2R)-N-[(2S)-1-[(6-amino-2-methyl-3-pyridinyl)methylamino]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-1-methyl-2-pyrrolidinecarboxamide
IUPAC NAME: (2R)-N-[(2S)-1-[(6-amino-2-methylpyridin-3-yl)methylamino]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-1-methylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2R)-N-[(2S)-1-[(6-azanyl-2-methyl-pyridin-3-yl)methylamino]-3-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl]-1-methyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C22H28FN5O2
MOLECULAR WEIGHT: 413.488423
SMILES: CC1=C(C=CC(=N1)N)CNC(=O)[C@H](CC2=CC=C(C=C2)F)NC(=O)[C@H]3CCCN3C
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Product OPENEYE NAME: (2R)-N-[(1S)-2-[(6-amino-2-methyl-3-pyridyl)methylamino]-1-[(3,4-difluorophenyl)methyl]-2-oxo-ethyl]-1-methyl-pyrrolidine-2-carboxamide
CAS Name: (2R)-N-[(2S)-1-[(6-amino-2-methyl-3-pyridinyl)methylamino]-3-(3,4-difluorophenyl)-1-oxopropan-2-yl]-1-methyl-2-pyrrolidinecarboxamide
IUPAC NAME: (2R)-N-[(2S)-1-[(6-amino-2-methylpyridin-3-yl)methylamino]-3-(3,4-difluorophenyl)-1-oxopropan-2-yl]-1-methylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2R)-N-[(2S)-1-[(6-azanyl-2-methyl-pyridin-3-yl)methylamino]-3-[3,4-bis(fluoranyl)phenyl]-1-oxidanylidene-propan-2-yl]-1-methyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C22H27F2N5O2
MOLECULAR WEIGHT: 431.478886
SMILES: CC1=C(C=CC(=N1)N)CNC(=O)[C@H](CC2=CC(=C(C=C2)F)F)NC(=O)[C@H]3CCCN3C
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Product OPENEYE NAME: (2S)-N-[(1R)-1-[(6-amino-3-pyridyl)methylcarbamoyl]-2,2-dicyclohexyl-ethyl]-1-methyl-pyrrolidine-2-carboxamide
CAS Name: (2S)-N-[(2R)-1-[(6-amino-3-pyridinyl)methylamino]-3,3-dicyclohexyl-1-oxopropan-2-yl]-1-methyl-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-N-[(2R)-1-[(6-aminopyridin-3-yl)methylamino]-3,3-dicyclohexyl-1-oxopropan-2-yl]-1-methylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-N-[(2R)-1-[(6-azanylpyridin-3-yl)methylamino]-3,3-dicyclohexyl-1-oxidanylidene-propan-2-yl]-1-methyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C27H43N5O2
MOLECULAR WEIGHT: 469.66262
SMILES: CN1CCC[C@H]1C(=O)N[C@H](C(C2CCCCC2)C3CCCCC3)C(=O)NCC4=CN=C(C=C4)N
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Product OPENEYE NAME: N-[(1S)-2-[(6-amino-3-pyridyl)methylamino]-1-[(3-fluorophenyl)methyl]-2-oxo-ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
CAS Name: N-[(2S)-1-[(6-amino-3-pyridinyl)methylamino]-3-(3-fluorophenyl)-1-oxopropan-2-yl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
IUPAC NAME: N-[(2S)-1-[(6-aminopyridin-3-yl)methylamino]-3-(3-fluorophenyl)-1-oxopropan-2-yl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-1-[(6-azanylpyridin-3-yl)methylamino]-3-(3-fluorophenyl)-1-oxidanylidene-propan-2-yl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
MOLECULAR FORMULA: C22H24FN5O2
MOLECULAR WEIGHT: 409.456663
SMILES: CC1=CC(=C(N1)C(=O)N[C@@H](CC2=CC(=CC=C2)F)C(=O)NCC3=CN=C(C=C3)N)C
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Product OPENEYE NAME: N-[(1S)-2-[(6-amino-3-pyridyl)methylamino]-1-[(4-fluorophenyl)methyl]-2-oxo-ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
CAS Name: N-[(2S)-1-[(6-amino-3-pyridinyl)methylamino]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
IUPAC NAME: N-[(2S)-1-[(6-aminopyridin-3-yl)methylamino]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-1-[(6-azanylpyridin-3-yl)methylamino]-3-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
MOLECULAR FORMULA: C22H24FN5O2
MOLECULAR WEIGHT: 409.456663
SMILES: CC1=CC(=C(N1)C(=O)N[C@@H](CC2=CC=C(C=C2)F)C(=O)NCC3=CN=C(C=C3)N)C
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Product OPENEYE NAME: 1-[1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazine-7-carbonyl)-4-piperidyl]-3-[4-(trifluoromethoxy)phenyl]urea
CAS Name: 1-[1-[(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)-oxomethyl]-4-piperidinyl]-3-[4-(trifluoromethoxy)phenyl]urea
IUPAC NAME: 1-[1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazine-7-carbonyl)piperidin-4-yl]-3-[4-(trifluoromethoxy)phenyl]urea
SYSTEMATIC NAME: 1-[1-[(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)carbonyl]piperidin-4-yl]-3-[4-(trifluoromethyloxy)phenyl]urea
MOLECULAR FORMULA: C22H24F3N5O4
MOLECULAR WEIGHT: 479.45227
SMILES: CN1CCOC2=C1N=CC(=C2)C(=O)N3CCC(CC3)NC(=O)NC4=CC=C(C=C4)OC(F)(F)F
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Product OPENEYE NAME: 1-[1-(5-chloropyridine-2-carbonyl)-4-piperidyl]-3-[4-(trifluoromethoxy)phenyl]urea
CAS Name: 1-[1-[(5-chloro-2-pyridinyl)-oxomethyl]-4-piperidinyl]-3-[4-(trifluoromethoxy)phenyl]urea
IUPAC NAME: 1-[1-(5-chloropyridine-2-carbonyl)piperidin-4-yl]-3-[4-(trifluoromethoxy)phenyl]urea
SYSTEMATIC NAME: 1-[1-(5-chloranylpyridin-2-yl)carbonylpiperidin-4-yl]-3-[4-(trifluoromethyloxy)phenyl]urea
MOLECULAR FORMULA: C19H18ClF3N4O3
MOLECULAR WEIGHT: 442.81943
SMILES: C1CN(CCC1NC(=O)NC2=CC=C(C=C2)OC(F)(F)F)C(=O)C3=NC=C(C=C3)Cl
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