Friday, December 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: (5S)-5'-[3-[(8R)-8-(3,5-difluorophenyl)-8,10-dimethyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-ynyl]-1-methyl-spiro[imidazolidine-5,2'-indane]-2,4-dione
CAS Name: (2S)-5-[3-[(8R)-8-(3,5-difluorophenyl)-8,10-dimethyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-ynyl]-1'-methylspiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione
IUPAC NAME: (2S)-5-[3-[(8R)-8-(3,5-difluorophenyl)-8,10-dimethyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-ynyl]-1'-methylspiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione
SYSTEMATIC NAME: (2S)-5-[3-[(8R)-8-[3,5-bis(fluoranyl)phenyl]-8,10-dimethyl-6-oxidanylidene-7,10-diazaspiro[4.5]decan-7-yl]prop-1-ynyl]-1'-methyl-spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione
MOLECULAR FORMULA: C31H32F2N4O3
MOLECULAR WEIGHT: 546.607586
SMILES: C[C@]1(CN(C2(CCCC2)C(=O)N1CC#CC3=CC4=C(C[C@]5(C4)C(=O)NC(=O)N5C)C=C3)C)C6=CC(=CC(=C6)F)F
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Product OPENEYE NAME: (3R)-5'-[3-[(6S)-6-(3,5-difluorophenyl)-3,3-dimethyl-2-oxo-1-piperidyl]prop-1-ynyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,2'-indane]-2-one
CAS Name: (2R)-5-[3-[(6S)-6-(3,5-difluorophenyl)-3,3-dimethyl-2-oxo-1-piperidinyl]prop-1-ynyl]-2'-spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]one
IUPAC NAME: (2R)-5-[3-[(6S)-6-(3,5-difluorophenyl)-3,3-dimethyl-2-oxopiperidin-1-yl]prop-1-ynyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
SYSTEMATIC NAME: (2R)-5-[3-[(6S)-6-[3,5-bis(fluoranyl)phenyl]-3,3-dimethyl-2-oxidanylidene-piperidin-1-yl]prop-1-ynyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
MOLECULAR FORMULA: C31H27F2N3O2
MOLECULAR WEIGHT: 511.561786
SMILES: CC1(CC[C@H](N(C1=O)CC#CC2=CC3=C(C[C@@]4(C3)C5=C(NC4=O)N=CC=C5)C=C2)C6=CC(=CC(=C6)F)F)C
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Product OPENEYE NAME: (3S)-3-[4-(dimethylamino)phenyl]-4-[3-[(3R)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,2'-indane]-5'-yl]prop-2-ynyl]-9-oxa-4-azaspiro[5.5]undecan-5-one
CAS Name: (3S)-3-[4-(dimethylamino)phenyl]-4-[3-[(2R)-2'-oxo-5-spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]yl]prop-2-ynyl]-9-oxa-4-azaspiro[5.5]undecan-5-one
IUPAC NAME: (3S)-3-[4-(dimethylamino)phenyl]-4-[3-[(2R)-2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl]prop-2-ynyl]-9-oxa-4-azaspiro[5.5]undecan-5-one
SYSTEMATIC NAME: (3S)-3-[4-(dimethylamino)phenyl]-4-[3-[(2R)-2'-oxidanylidenespiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl]prop-2-ynyl]-9-oxa-4-azaspiro[5.5]undecan-5-one
MOLECULAR FORMULA: C35H36N4O3
MOLECULAR WEIGHT: 560.68534
SMILES: CN(C)C1=CC=C(C=C1)[C@@H]2CCC3(CCOCC3)C(=O)N2CC#CC4=CC5=C(C[C@@]6(C5)C7=C(NC6=O)N=CC=C7)C=C4
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Product OPENEYE NAME: (3R)-5'-[3-[(2R)-2-(3,5-difluorophenyl)-2,5,5-trimethyl-6-oxo-piperazin-1-yl]prop-1-ynyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,2'-indane]-2-one
CAS Name: (2R)-5-[3-[(2R)-2-(3,5-difluorophenyl)-2,5,5-trimethyl-6-oxo-1-piperazinyl]prop-1-ynyl]-2'-spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]one
IUPAC NAME: (2R)-5-[3-[(2R)-2-(3,5-difluorophenyl)-2,5,5-trimethyl-6-oxopiperazin-1-yl]prop-1-ynyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
SYSTEMATIC NAME: (2R)-5-[3-[(2R)-2-[3,5-bis(fluoranyl)phenyl]-2,5,5-trimethyl-6-oxidanylidene-piperazin-1-yl]prop-1-ynyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
MOLECULAR FORMULA: C31H28F2N4O2
MOLECULAR WEIGHT: 526.576426
SMILES: C[C@]1(CNC(C(=O)N1CC#CC2=CC3=C(C[C@@]4(C3)C5=C(NC4=O)N=CC=C5)C=C2)(C)C)C6=CC(=CC(=C6)F)F
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Product OPENEYE NAME: 2-morpholinoethyl (E)-7-[(1R,2S,3R)-3-chloro-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]hept-5-enoate
CAS Name: (E)-7-[(1R,2S,3R)-3-chloro-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]-5-heptenoic acid 2-(4-morpholinyl)ethyl ester
IUPAC NAME: 2-morpholin-4-ylethyl (E)-7-[(1R,2S,3R)-3-chloro-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]hept-5-enoate
SYSTEMATIC NAME: 2-morpholin-4-ylethyl (E)-7-[(1R,2S,3R)-3-chloranyl-2-[4-[(1R)-1-oxidanylhexyl]phenyl]cyclopentyl]hept-5-enoate
MOLECULAR FORMULA: C30H46ClNO4
MOLECULAR WEIGHT: 520.14354
SMILES: CCCCC[C@H](C1=CC=C(C=C1)[C@@H]2[C@H](CC[C@H]2Cl)C/C=C/CCCC(=O)OCCN3CCOCC3)O
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Product OPENEYE NAME: 2-morpholinoethyl (E)-7-[(1R,2S,3R)-3-hydroxy-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]hept-5-enoate
CAS Name: (E)-7-[(1R,2S,3R)-3-hydroxy-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]-5-heptenoic acid 2-(4-morpholinyl)ethyl ester
IUPAC NAME: 2-morpholin-4-ylethyl (E)-7-[(1R,2S,3R)-3-hydroxy-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]hept-5-enoate
SYSTEMATIC NAME: 2-morpholin-4-ylethyl (E)-7-[(1R,2S,3R)-3-oxidanyl-2-[4-[(1R)-1-oxidanylhexyl]phenyl]cyclopentyl]hept-5-enoate
MOLECULAR FORMULA: C30H47NO5
MOLECULAR WEIGHT: 501.69788
SMILES: CCCCC[C@H](C1=CC=C(C=C1)[C@@H]2[C@H](CC[C@H]2O)C/C=C/CCCC(=O)OCCN3CCOCC3)O
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Product OPENEYE NAME: 2-hydroxyethyl (E)-7-[(1R,2S,3R)-3-hydroxy-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]hept-5-enoate
CAS Name: (E)-7-[(1R,2S,3R)-3-hydroxy-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]-5-heptenoic acid 2-hydroxyethyl ester
IUPAC NAME: 2-hydroxyethyl (E)-7-[(1R,2S,3R)-3-hydroxy-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]hept-5-enoate
SYSTEMATIC NAME: 2-hydroxyethyl (E)-7-[(1R,2S,3R)-3-oxidanyl-2-[4-[(1R)-1-oxidanylhexyl]phenyl]cyclopentyl]hept-5-enoate
MOLECULAR FORMULA: C26H40O5
MOLECULAR WEIGHT: 432.5928
SMILES: CCCCC[C@H](C1=CC=C(C=C1)[C@@H]2[C@H](CC[C@H]2O)C/C=C/CCCC(=O)OCCO)O
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Product OPENEYE NAME: 2-hydroxyethyl (E)-7-[(1R,2S,3S)-3-chloro-2-[4-(1-hydroxyhexyl)phenyl]cyclopentyl]hept-5-enoate
CAS Name: (E)-7-[(1R,2S,3S)-3-chloro-2-[4-(1-hydroxyhexyl)phenyl]cyclopentyl]-5-heptenoic acid 2-hydroxyethyl ester
IUPAC NAME: 2-hydroxyethyl (E)-7-[(1R,2S,3S)-3-chloro-2-[4-(1-hydroxyhexyl)phenyl]cyclopentyl]hept-5-enoate
SYSTEMATIC NAME: 2-hydroxyethyl (E)-7-[(1R,2S,3S)-3-chloranyl-2-[4-(1-oxidanylhexyl)phenyl]cyclopentyl]hept-5-enoate
MOLECULAR FORMULA: C26H39ClO4
MOLECULAR WEIGHT: 451.03846
SMILES: CCCCCC(C1=CC=C(C=C1)[C@@H]2[C@H](CC[C@@H]2Cl)C/C=C/CCCC(=O)OCCO)O
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Product OPENEYE NAME: 2-morpholinoethyl (E)-7-[(1R,2S,3S)-3-chloro-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]hept-5-enoate
CAS Name: (E)-7-[(1R,2S,3S)-3-chloro-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]-5-heptenoic acid 2-(4-morpholinyl)ethyl ester
IUPAC NAME: 2-morpholin-4-ylethyl (E)-7-[(1R,2S,3S)-3-chloro-2-[4-[(1R)-1-hydroxyhexyl]phenyl]cyclopentyl]hept-5-enoate
SYSTEMATIC NAME: 2-morpholin-4-ylethyl (E)-7-[(1R,2S,3S)-3-chloranyl-2-[4-[(1R)-1-oxidanylhexyl]phenyl]cyclopentyl]hept-5-enoate
MOLECULAR FORMULA: C30H46ClNO4
MOLECULAR WEIGHT: 520.14354
SMILES: CCCCC[C@H](C1=CC=C(C=C1)[C@@H]2[C@H](CC[C@@H]2Cl)C/C=C/CCCC(=O)OCCN3CCOCC3)O
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