Sunday, January 1, 2012

All Chemical Compounds Information



Product OPENEYE NAME: 6-cyano-1-(4-fluorophenyl)-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]indazole-4-carboxamide
CAS Name: 6-cyano-1-(4-fluorophenyl)-N-[[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]methyl]-4-indazolecarboxamide
IUPAC NAME: 6-cyano-1-(4-fluorophenyl)-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]indazole-4-carboxamide
SYSTEMATIC NAME: 6-cyano-1-(4-fluorophenyl)-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]indazole-4-carboxamide
MOLECULAR FORMULA: C27H25FN6O3S
MOLECULAR WEIGHT: 532.589203
SMILES: CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=C4C=NN(C4=CC(=C3)C#N)C5=CC=C(C=C5)F
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Product OPENEYE NAME: 6-cyano-1-(4-fluorophenyl)-N-[[6-(methanesulfonamido)-3-pyridyl]methyl]indazole-4-carboxamide
CAS Name: 6-cyano-1-(4-fluorophenyl)-N-[[6-(methanesulfonamido)-3-pyridinyl]methyl]-4-indazolecarboxamide
IUPAC NAME: 6-cyano-1-(4-fluorophenyl)-N-[[6-(methanesulfonamido)pyridin-3-yl]methyl]indazole-4-carboxamide
SYSTEMATIC NAME: 6-cyano-1-(4-fluorophenyl)-N-[[6-(methylsulfonylamino)pyridin-3-yl]methyl]indazole-4-carboxamide
MOLECULAR FORMULA: C22H17FN6O3S
MOLECULAR WEIGHT: 464.472183
SMILES: CS(=O)(=O)NC1=NC=C(C=C1)CNC(=O)C2=C3C=NN(C3=CC(=C2)C#N)C4=CC=C(C=C4)F
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Product OPENEYE NAME: N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CAS Name: N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)-4-indazolecarboxamide
IUPAC NAME: N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
SYSTEMATIC NAME: N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
MOLECULAR FORMULA: C23H21FN4O3S
MOLECULAR WEIGHT: 452.501243
SMILES: CN(C)S(=O)(=O)C1=CC=CC(=C1)CNC(=O)C2=C3C=NN(C3=CC=C2)C4=CC=C(C=C4)F
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Product OPENEYE NAME: (3R)-5'-[(E)-3-[(9R)-9-(3,5-difluorophenyl)-9-methyl-7-oxo-8,11-diazaspiro[5.5]undecan-8-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,2'-indane]-2-one
CAS Name: (2R)-5-[(E)-3-[(9R)-9-(3,5-difluorophenyl)-9-methyl-7-oxo-8,11-diazaspiro[5.5]undecan-8-yl]prop-1-enyl]-2'-spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]one
IUPAC NAME: (2R)-5-[(E)-3-[(9R)-9-(3,5-difluorophenyl)-9-methyl-7-oxo-8,11-diazaspiro[5.5]undecan-8-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
SYSTEMATIC NAME: (2R)-5-[(E)-3-[(9R)-9-[3,5-bis(fluoranyl)phenyl]-9-methyl-7-oxidanylidene-8,11-diazaspiro[5.5]undecan-8-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
MOLECULAR FORMULA: C34H34F2N4O2
MOLECULAR WEIGHT: 568.656166
SMILES: C[C@]1(CNC2(CCCCC2)C(=O)N1C/C=C/C3=CC4=C(C[C@@]5(C4)C6=C(NC5=O)N=CC=C6)C=C3)C7=CC(=CC(=C7)F)F
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Product OPENEYE NAME: (3R)-5'-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-10-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,2'-indane]-2-one
CAS Name: (2R)-5-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-10-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]-2'-spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]one
IUPAC NAME: (2R)-5-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-10-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
SYSTEMATIC NAME: (2R)-5-[(E)-3-[(8R)-8-[3,5-bis(fluoranyl)phenyl]-10-methyl-6-oxidanylidene-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
MOLECULAR FORMULA: C33H32F2N4O2
MOLECULAR WEIGHT: 554.629586
SMILES: CN1C[C@H](N(C(=O)C12CCCC2)C/C=C/C3=CC4=C(C[C@@]5(C4)C6=C(NC5=O)N=CC=C6)C=C3)C7=CC(=CC(=C7)F)F
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Product OPENEYE NAME: (3R)-5'-[(E)-3-[(8R)-8-(4-chloro-3,5-difluoro-phenyl)-8-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,2'-indane]-2-one
CAS Name: (2R)-5-[(E)-3-[(8R)-8-(4-chloro-3,5-difluorophenyl)-8-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]-2'-spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]one
IUPAC NAME: (2R)-5-[(E)-3-[(8R)-8-(4-chloro-3,5-difluorophenyl)-8-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
SYSTEMATIC NAME: (2R)-5-[(E)-3-[(8R)-8-[4-chloranyl-3,5-bis(fluoranyl)phenyl]-8-methyl-6-oxidanylidene-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
MOLECULAR FORMULA: C33H31ClF2N4O2
MOLECULAR WEIGHT: 589.074646
SMILES: C[C@]1(CNC2(CCCC2)C(=O)N1C/C=C/C3=CC4=C(C[C@@]5(C4)C6=C(NC5=O)N=CC=C6)C=C3)C7=CC(=C(C(=C7)F)Cl)F
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Product OPENEYE NAME: (3S)-3'-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-8,10-dimethyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-2-one
CAS Name: (3S)-3'-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-8,10-dimethyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]-2-spiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]one
IUPAC NAME: (3S)-3'-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-8,10-dimethyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-2-one
SYSTEMATIC NAME: (3S)-3'-[(E)-3-[(8R)-8-[3,5-bis(fluoranyl)phenyl]-8,10-dimethyl-6-oxidanylidene-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-2-one
MOLECULAR FORMULA: C33H33F2N5O2
MOLECULAR WEIGHT: 569.644226
SMILES: C[C@]1(CN(C2(CCCC2)C(=O)N1C/C=C/C3=CC4=C(C[C@@]5(C4)C6=C(NC5=O)N=CC=C6)N=C3)C)C7=CC(=CC(=C7)F)F
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Product OPENEYE NAME: 1-(2-acetamidoethyl)-N-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)-2-oxo-quinoxaline-6-carboxamide
CAS Name: 1-(2-acetamidoethyl)-N-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)-2-oxo-6-quinoxalinecarboxamide
IUPAC NAME: 1-(2-acetamidoethyl)-N-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)-2-oxoquinoxaline-6-carboxamide
SYSTEMATIC NAME: 1-(2-acetamidoethyl)-N-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)-2-oxidanylidene-quinoxaline-6-carboxamide
MOLECULAR FORMULA: C27H24Cl2N4O4
MOLECULAR WEIGHT: 539.40986
SMILES: CC(=O)NCCN1C2=C(C=C(C=C2)C(=O)NCC3=CC(=C(C=C3)Cl)Cl)N=C(C1=O)C4=CC=C(C=C4)OC
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Product OPENEYE NAME: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-pyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
CAS Name: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-4-pyrido[2,3-b]pyrazinyl]ethyl]acetamide
IUPAC NAME: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxopyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
SYSTEMATIC NAME: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxidanylidene-pyrido[2,3-b]pyrazin-4-yl]ethyl]ethanamide
MOLECULAR FORMULA: C25H23Cl2N5O3
MOLECULAR WEIGHT: 512.38782
SMILES: CC(=O)NCCN1C2=NC=C(C=C2N=C(C1=O)C3=CC=C(C=C3)OC)NCC4=CC(=C(C=C4)Cl)Cl
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Product OPENEYE NAME: N-[2-[7-[(4-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-pyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
CAS Name: N-[2-[7-[(4-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-4-pyrido[2,3-b]pyrazinyl]ethyl]acetamide
IUPAC NAME: N-[2-[7-[(4-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxopyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
SYSTEMATIC NAME: N-[2-[7-[(4-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxidanylidene-pyrido[2,3-b]pyrazin-4-yl]ethyl]ethanamide
MOLECULAR FORMULA: C25H24ClN5O3
MOLECULAR WEIGHT: 477.94276
SMILES: CC(=O)NCCN1C2=NC=C(C=C2N=C(C1=O)C3=CC=C(C=C3)OC)NCC4=CC=C(C=C4)Cl
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Product OPENEYE NAME: N-[2-[7-[(3-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-pyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
CAS Name: N-[2-[7-[(3-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-4-pyrido[2,3-b]pyrazinyl]ethyl]acetamide
IUPAC NAME: N-[2-[7-[(3-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxopyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
SYSTEMATIC NAME: N-[2-[7-[(3-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxidanylidene-pyrido[2,3-b]pyrazin-4-yl]ethyl]ethanamide
MOLECULAR FORMULA: C25H24ClN5O3
MOLECULAR WEIGHT: 477.94276
SMILES: CC(=O)NCCN1C2=NC=C(C=C2N=C(C1=O)C3=CC=C(C=C3)OC)NCC4=CC(=CC=C4)Cl
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Product OPENEYE NAME: N-[2-[2-(4-methoxyphenyl)-7-[(4-methoxyphenyl)methylamino]-3-oxo-pyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
CAS Name: N-[2-[2-(4-methoxyphenyl)-7-[(4-methoxyphenyl)methylamino]-3-oxo-4-pyrido[2,3-b]pyrazinyl]ethyl]acetamide
IUPAC NAME: N-[2-[2-(4-methoxyphenyl)-7-[(4-methoxyphenyl)methylamino]-3-oxopyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
SYSTEMATIC NAME: N-[2-[2-(4-methoxyphenyl)-7-[(4-methoxyphenyl)methylamino]-3-oxidanylidene-pyrido[2,3-b]pyrazin-4-yl]ethyl]ethanamide
MOLECULAR FORMULA: C26H27N5O4
MOLECULAR WEIGHT: 473.52368
SMILES: CC(=O)NCCN1C2=NC=C(C=C2N=C(C1=O)C3=CC=C(C=C3)OC)NCC4=CC=C(C=C4)OC
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Product OPENEYE NAME: 2-[(4-cyanophenyl)methyl]-N-[1-[[4-(trifluoromethyl)phenyl]methyl]-4-piperidyl]-3,4-dihydro-1H-isoquinoline-7-carboxamide
CAS Name: 2-[(4-cyanophenyl)methyl]-N-[1-[[4-(trifluoromethyl)phenyl]methyl]-4-piperidinyl]-3,4-dihydro-1H-isoquinoline-7-carboxamide
IUPAC NAME: 2-[(4-cyanophenyl)methyl]-N-[1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]-3,4-dihydro-1H-isoquinoline-7-carboxamide
SYSTEMATIC NAME: 2-[(4-cyanophenyl)methyl]-N-[1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]-3,4-dihydro-1H-isoquinoline-7-carboxamide
MOLECULAR FORMULA: C31H31F3N4O
MOLECULAR WEIGHT: 532.59925
SMILES: C1CN(CCC1NC(=O)C2=CC3=C(CCN(C3)CC4=CC=C(C=C4)C#N)C=C2)CC5=CC=C(C=C5)C(F)(F)F
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