Monday, December 26, 2011

All Chemical Compounds Information



Product OPENEYE NAME: 2-[3-(3-chlorophenyl)-7-[3-(dimethylamino)-1-piperidyl]-1-oxo-pyrrolo[1,2-a]pyrazin-2-yl]-N-isopropyl-acetamide
CAS Name: 2-[3-(3-chlorophenyl)-7-[3-(dimethylamino)-1-piperidinyl]-1-oxo-2-pyrrolo[1,2-a]pyrazinyl]-N-propan-2-ylacetamide
IUPAC NAME: 2-[3-(3-chlorophenyl)-7-[3-(dimethylamino)piperidin-1-yl]-1-oxopyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide
SYSTEMATIC NAME: 2-[3-(3-chlorophenyl)-7-[3-(dimethylamino)piperidin-1-yl]-1-oxidanylidene-pyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C25H32ClN5O2
MOLECULAR WEIGHT: 470.00688
SMILES: CC(C)NC(=O)CN1C(=CN2C=C(C=C2C1=O)N3CCCC(C3)N(C)C)C4=CC(=CC=C4)Cl
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Product OPENEYE NAME: 2-[3-(3-chlorophenyl)-7-[3-(dimethylamino)pyrrolidin-1-yl]-1-oxo-pyrrolo[1,2-a]pyrazin-2-yl]-N-isopropyl-acetamide
CAS Name: 2-[3-(3-chlorophenyl)-7-[3-(dimethylamino)-1-pyrrolidinyl]-1-oxo-2-pyrrolo[1,2-a]pyrazinyl]-N-propan-2-ylacetamide
IUPAC NAME: 2-[3-(3-chlorophenyl)-7-[3-(dimethylamino)pyrrolidin-1-yl]-1-oxopyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide
SYSTEMATIC NAME: 2-[3-(3-chlorophenyl)-7-[3-(dimethylamino)pyrrolidin-1-yl]-1-oxidanylidene-pyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C24H30ClN5O2
MOLECULAR WEIGHT: 455.9803
SMILES: CC(C)NC(=O)CN1C(=CN2C=C(C=C2C1=O)N3CCC(C3)N(C)C)C4=CC(=CC=C4)Cl
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Product OPENEYE NAME: 2-[3-(3-chlorophenyl)-7-(9-methyl-4,9-diazaspiro[5.5]undecan-4-yl)-1-oxo-pyrrolo[1,2-a]pyrazin-2-yl]-N-isopropyl-acetamide
CAS Name: 2-[3-(3-chlorophenyl)-7-(9-methyl-4,9-diazaspiro[5.5]undecan-4-yl)-1-oxo-2-pyrrolo[1,2-a]pyrazinyl]-N-propan-2-ylacetamide
IUPAC NAME: 2-[3-(3-chlorophenyl)-7-(9-methyl-4,9-diazaspiro[5.5]undecan-4-yl)-1-oxopyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide
SYSTEMATIC NAME: 2-[3-(3-chlorophenyl)-7-(9-methyl-4,9-diazaspiro[5.5]undecan-4-yl)-1-oxidanylidene-pyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C28H36ClN5O2
MOLECULAR WEIGHT: 510.07074
SMILES: CC(C)NC(=O)CN1C(=CN2C=C(C=C2C1=O)N3CCCC4(C3)CCN(CC4)C)C5=CC(=CC=C5)Cl
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Product OPENEYE NAME: 2-[3-(3-chlorophenyl)-7-[(1-methyl-4-piperidyl)methoxy]-1-oxo-pyrrolo[1,2-a]pyrazin-2-yl]-N-isopropyl-acetamide
CAS Name: 2-[3-(3-chlorophenyl)-7-[(1-methyl-4-piperidinyl)methoxy]-1-oxo-2-pyrrolo[1,2-a]pyrazinyl]-N-propan-2-ylacetamide
IUPAC NAME: 2-[3-(3-chlorophenyl)-7-[(1-methylpiperidin-4-yl)methoxy]-1-oxopyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide
SYSTEMATIC NAME: 2-[3-(3-chlorophenyl)-7-[(1-methylpiperidin-4-yl)methoxy]-1-oxidanylidene-pyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C25H31ClN4O3
MOLECULAR WEIGHT: 470.99164
SMILES: CC(C)NC(=O)CN1C(=CN2C=C(C=C2C1=O)OCC3CCN(CC3)C)C4=CC(=CC=C4)Cl
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Product OPENEYE NAME: 8-chloro-N-[(R)-cyclopropyl-(3-fluorophenyl)methyl]-3-methyl-1-oxo-2-phenyl-isoquinoline-4-carboxamide
CAS Name: 8-chloro-N-[(R)-cyclopropyl-(3-fluorophenyl)methyl]-3-methyl-1-oxo-2-phenyl-4-isoquinolinecarboxamide
IUPAC NAME: 8-chloro-N-[(R)-cyclopropyl-(3-fluorophenyl)methyl]-3-methyl-1-oxo-2-phenylisoquinoline-4-carboxamide
SYSTEMATIC NAME: 8-chloranyl-N-[(R)-cyclopropyl-(3-fluorophenyl)methyl]-3-methyl-1-oxidanylidene-2-phenyl-isoquinoline-4-carboxamide
MOLECULAR FORMULA: C27H22ClFN2O2
MOLECULAR WEIGHT: 460.927183
SMILES: CC1=C(C2=C(C(=CC=C2)Cl)C(=O)N1C3=CC=CC=C3)C(=O)N[C@H](C4CC4)C5=CC(=CC=C5)F
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Product OPENEYE NAME: sodium 4-[(3E,5E)-3,5-bis(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2,4-triazolidin-1-yl]benzoate
CAS Name: sodium 4-[(3E,5E)-3,5-bis(6-oxo-1-cyclohexa-2,4-dienylidene)-1,2,4-triazolidin-1-yl]benzoate
IUPAC NAME: sodium 4-[(3E,5E)-3,5-bis(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2,4-triazolidin-1-yl]benzoate
SYSTEMATIC NAME: sodium 4-[(3E,5E)-3,5-bis(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,2,4-triazolidin-1-yl]benzoate
MOLECULAR FORMULA: C21H14N3NaO4
MOLECULAR WEIGHT: 395.34333
SMILES: C1=C/C(=C\2/N/C(=C\3/C=CC=CC3=O)/N(N2)C4=CC=C(C=C4)C(=O)[O-])/C(=O)C=C1.[Na+]
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Product OPENEYE NAME: potassium 4-[(3E,5E)-3,5-bis(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2,4-triazolidin-1-yl]benzoate
CAS Name: potassium 4-[(3E,5E)-3,5-bis(6-oxo-1-cyclohexa-2,4-dienylidene)-1,2,4-triazolidin-1-yl]benzoate
IUPAC NAME: potassium 4-[(3E,5E)-3,5-bis(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2,4-triazolidin-1-yl]benzoate
SYSTEMATIC NAME: potassium 4-[(3E,5E)-3,5-bis(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,2,4-triazolidin-1-yl]benzoate
MOLECULAR FORMULA: C21H14KN3O4
MOLECULAR WEIGHT: 411.45186
SMILES: C1=C/C(=C\2/N/C(=C\3/C=CC=CC3=O)/N(N2)C4=CC=C(C=C4)C(=O)[O-])/C(=O)C=C1.[K+]
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Product OPENEYE NAME: (4aR,7aS)-2-amino-7a-(3-chloro-2,4-difluoro-phenyl)-6-(5-fluoro-4-methoxy-6-methyl-pyrimidin-2-yl)-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
CAS Name: (4aR,7aS)-2-amino-7a-(3-chloro-2,4-difluorophenyl)-6-(5-fluoro-4-methoxy-6-methyl-2-pyrimidinyl)-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
IUPAC NAME: (4aR,7aS)-2-amino-7a-(3-chloro-2,4-difluorophenyl)-6-(5-fluoro-4-methoxy-6-methylpyrimidin-2-yl)-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
SYSTEMATIC NAME: (4aR,7aS)-2-azanyl-7a-[3-chloranyl-2,4-bis(fluoranyl)phenyl]-6-(5-fluoranyl-4-methoxy-6-methyl-pyrimidin-2-yl)-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
MOLECULAR FORMULA: C19H18ClF3N6O2
MOLECULAR WEIGHT: 454.83343
SMILES: CC1=C(C(=NC(=N1)N2C[C@H]3C(=O)N(C(=N[C@]3(C2)C4=C(C(=C(C=C4)F)Cl)F)N)C)OC)F
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Product OPENEYE NAME: (4aR,7aS)-2-amino-6-(5-fluoro-4-methoxy-6-methyl-pyrimidin-2-yl)-3-methyl-7a-(2,3,6-trifluorophenyl)-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
CAS Name: (4aR,7aS)-2-amino-6-(5-fluoro-4-methoxy-6-methyl-2-pyrimidinyl)-3-methyl-7a-(2,3,6-trifluorophenyl)-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
IUPAC NAME: (4aR,7aS)-2-amino-6-(5-fluoro-4-methoxy-6-methylpyrimidin-2-yl)-3-methyl-7a-(2,3,6-trifluorophenyl)-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
SYSTEMATIC NAME: (4aR,7aS)-2-azanyl-6-(5-fluoranyl-4-methoxy-6-methyl-pyrimidin-2-yl)-3-methyl-7a-[2,3,6-tris(fluoranyl)phenyl]-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
MOLECULAR FORMULA: C19H18F4N6O2
MOLECULAR WEIGHT: 438.378833
SMILES: CC1=C(C(=NC(=N1)N2C[C@H]3C(=O)N(C(=N[C@]3(C2)C4=C(C=CC(=C4F)F)F)N)C)OC)F
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Product OPENEYE NAME: (4aR,7aS)-2-amino-7a-(2,4-difluorophenyl)-6-[5-fluoro-4-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
CAS Name: (4aR,7aS)-2-amino-7a-(2,4-difluorophenyl)-6-[5-fluoro-4-methoxy-6-(trifluoromethyl)-2-pyrimidinyl]-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
IUPAC NAME: (4aR,7aS)-2-amino-7a-(2,4-difluorophenyl)-6-[5-fluoro-4-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
SYSTEMATIC NAME: (4aR,7aS)-2-azanyl-7a-[2,4-bis(fluoranyl)phenyl]-6-[5-fluoranyl-4-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
MOLECULAR FORMULA: C19H16F6N6O2
MOLECULAR WEIGHT: 474.359759
SMILES: CN1C(=O)[C@@H]2CN(C[C@@]2(N=C1N)C3=C(C=C(C=C3)F)F)C4=NC(=C(C(=N4)OC)F)C(F)(F)F
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Product OPENEYE NAME: (4aR,7aS)-2-amino-6-[4-(1,1-difluoroethyl)-5-fluoro-6-methoxy-pyrimidin-2-yl]-7a-(2,4-difluorophenyl)-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
CAS Name: (4aR,7aS)-2-amino-6-[4-(1,1-difluoroethyl)-5-fluoro-6-methoxy-2-pyrimidinyl]-7a-(2,4-difluorophenyl)-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
IUPAC NAME: (4aR,7aS)-2-amino-6-[4-(1,1-difluoroethyl)-5-fluoro-6-methoxypyrimidin-2-yl]-7a-(2,4-difluorophenyl)-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
SYSTEMATIC NAME: (4aR,7aS)-2-azanyl-6-[4-[1,1-bis(fluoranyl)ethyl]-5-fluoranyl-6-methoxy-pyrimidin-2-yl]-7a-[2,4-bis(fluoranyl)phenyl]-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
MOLECULAR FORMULA: C20H19F5N6O2
MOLECULAR WEIGHT: 470.395876
SMILES: CC(C1=C(C(=NC(=N1)N2C[C@H]3C(=O)N(C(=N[C@]3(C2)C4=C(C=C(C=C4)F)F)N)C)OC)F)(F)F
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Product OPENEYE NAME: (4aR,7aS)-2-amino-7a-(2,4-difluorophenyl)-6-[5-fluoro-4-(hydroxymethyl)-6-methoxy-pyrimidin-2-yl]-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
CAS Name: (4aR,7aS)-2-amino-7a-(2,4-difluorophenyl)-6-[5-fluoro-4-(hydroxymethyl)-6-methoxy-2-pyrimidinyl]-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
IUPAC NAME: (4aR,7aS)-2-amino-7a-(2,4-difluorophenyl)-6-[5-fluoro-4-(hydroxymethyl)-6-methoxypyrimidin-2-yl]-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
SYSTEMATIC NAME: (4aR,7aS)-2-azanyl-7a-[2,4-bis(fluoranyl)phenyl]-6-[5-fluoranyl-4-(hydroxymethyl)-6-methoxy-pyrimidin-2-yl]-3-methyl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one
MOLECULAR FORMULA: C19H19F3N6O3
MOLECULAR WEIGHT: 436.38777
SMILES: CN1C(=O)[C@@H]2CN(C[C@@]2(N=C1N)C3=C(C=C(C=C3)F)F)C4=NC(=C(C(=N4)OC)F)CO
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Product OPENEYE NAME: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenyl-propanoyl]amino]-3-methyl-pentanoyl]amino]butanedioic acid
CAS Name: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]-3-methyl-1-oxopentyl]amino]butanedioic acid
IUPAC NAME: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-3-methylpentanoyl]amino]butanedioic acid
SYSTEMATIC NAME: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[2-[2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]ethanoylamino]ethanoylamino]-3-phenyl-propanoyl]amino]-3-methyl-pentanoyl]amino]butanedioic acid
MOLECULAR FORMULA: C32H42N6O10
MOLECULAR WEIGHT: 670.71008
SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@H](CC2=CC=C(C=C2)O)N
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Product OPENEYE NAME: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenyl-propanoyl]amino]-3-methyl-pentanoyl]amino]butanedioic acid
CAS Name: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]-3-methyl-1-oxopentyl]amino]butanedioic acid
IUPAC NAME: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-3-methylpentanoyl]amino]butanedioic acid
SYSTEMATIC NAME: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[2-[[(2S)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoylamino]-3-phenyl-propanoyl]amino]-3-methyl-pentanoyl]amino]butanedioic acid
MOLECULAR FORMULA: C33H44N6O10
MOLECULAR WEIGHT: 684.73666
SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC2=CC=C(C=C2)O)N
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Product OPENEYE NAME: (2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoyl]amino]butanedioic acid
CAS Name: (2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]-4-(methylthio)-1-oxobutyl]amino]butanedioic acid
IUPAC NAME: (2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoyl]amino]butanedioic acid
SYSTEMATIC NAME: (2S)-2-[[(2S)-2-[[(2S)-2-[2-[2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]ethanoylamino]ethanoylamino]-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoyl]amino]butanedioic acid
MOLECULAR FORMULA: C31H40N6O10S
MOLECULAR WEIGHT: 688.7485
SMILES: CSCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@H](CC2=CC=C(C=C2)O)N
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Product OPENEYE NAME: (2R)-2-[(5R,10S,13R,14R,16R,17R)-3,16-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-5-methylene-heptanoic acid
CAS Name: (2R)-2-[(5R,10S,13R,14R,16R,17R)-3,16-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-5-methyleneheptanoic acid
IUPAC NAME: (2R)-2-[(5R,10S,13R,14R,16R,17R)-3,16-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-5-methylideneheptanoic acid
SYSTEMATIC NAME: (2R)-6-methyl-5-methylidene-2-[(5R,10S,13R,14R,16R,17R)-4,4,10,13,14-pentamethyl-3,16-bis(oxidanyl)-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]heptanoic acid
MOLECULAR FORMULA: C31H48O4
MOLECULAR WEIGHT: 484.71042
SMILES: CC(C)C(=C)CC[C@H]([C@H]1[C@@H](C[C@@]2([C@@]1(CC=C3C2=CC[C@@H]4[C@@]3(CCC(C4(C)C)O)C)C)C)O)C(=O)O
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Product OPENEYE NAME: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-N-(1-piperidyl)-4-(2,2,2-trideuterioethyl)pyrazole-3-carboxamide
CAS Name: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-N-(1-piperidinyl)-4-(2,2,2-trideuterioethyl)-3-pyrazolecarboxamide
IUPAC NAME: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-N-piperidin-1-yl-4-(2,2,2-trideuterioethyl)pyrazole-3-carboxamide
SYSTEMATIC NAME: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-N-piperidin-1-yl-4-(2,2,2-trideuterioethyl)pyrazole-3-carboxamide
MOLECULAR FORMULA: C23H23Cl3N4O
MOLECULAR WEIGHT: 480.832405
SMILES: [2H]C([2H])([2H])CC1=C(N(N=C1C(=O)NN2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: 2-(2-fluoranylethyl)naphthalene
CAS Name: 2-(2-fluoranylethyl)naphthalene
IUPAC NAME: 2-(2-fluoranylethyl)naphthalene
SYSTEMATIC NAME: 2-(2-fluoranylethyl)naphthalene
MOLECULAR FORMULA: C12H11F
MOLECULAR WEIGHT: 173.216678
SMILES: C1=CC=C2C=C(C=CC2=C1)CC[18F]
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Product OPENEYE NAME: N-[1-(4-tert-butylpiperazine-1-carbonyl)cyclohexyl]-3,3-diphenyl-propanamide
CAS Name: N-[1-[(4-tert-butyl-1-piperazinyl)-oxomethyl]cyclohexyl]-3,3-diphenylpropanamide
IUPAC NAME: N-[1-(4-tert-butylpiperazine-1-carbonyl)cyclohexyl]-3,3-diphenylpropanamide
SYSTEMATIC NAME: N-[1-(4-tert-butylpiperazin-1-yl)carbonylcyclohexyl]-3,3-diphenyl-propanamide
MOLECULAR FORMULA: C30H41N3O2
MOLECULAR WEIGHT: 475.66544
SMILES: CC(C)(C)N1CCN(CC1)C(=O)C2(CCCCC2)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 5-[2,5-bis[(4-chlorophenyl)methoxy]phenyl]-1H-imidazole
CAS Name: 5-[2,5-bis[(4-chlorophenyl)methoxy]phenyl]-1H-imidazole
IUPAC NAME: 5-[2,5-bis[(4-chlorophenyl)methoxy]phenyl]-1H-imidazole
SYSTEMATIC NAME: 5-[2,5-bis[(4-chlorophenyl)methoxy]phenyl]-1H-imidazole
MOLECULAR FORMULA: C23H18Cl2N2O2
MOLECULAR WEIGHT: 425.30722
SMILES: C1=CC(=CC=C1COC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)C4=CN=CN4)Cl
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Product OPENEYE NAME: 6-[2-(1H-imidazol-5-yl)phenoxy]-4,4-dimethyl-hexanoic acid hydrochloride
CAS Name: 6-[2-(1H-imidazol-5-yl)phenoxy]-4,4-dimethylhexanoic acid hydrochloride
IUPAC NAME: 6-[2-(1H-imidazol-5-yl)phenoxy]-4,4-dimethylhexanoic acid hydrochloride
SYSTEMATIC NAME: 6-[2-(1H-imidazol-5-yl)phenoxy]-4,4-dimethyl-hexanoic acid hydrochloride
MOLECULAR FORMULA: C17H23ClN2O3
MOLECULAR WEIGHT: 338.82912
SMILES: CC(C)(CCC(=O)O)CCOC1=CC=CC=C1C2=CN=CN2.Cl
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Product OPENEYE NAME: 6-[2-(1H-imidazol-5-yl)phenoxy]-4,4-dimethyl-hexanoic acid
CAS Name: 6-[2-(1H-imidazol-5-yl)phenoxy]-4,4-dimethylhexanoic acid
IUPAC NAME: 6-[2-(1H-imidazol-5-yl)phenoxy]-4,4-dimethylhexanoic acid
SYSTEMATIC NAME: 6-[2-(1H-imidazol-5-yl)phenoxy]-4,4-dimethyl-hexanoic acid
MOLECULAR FORMULA: C17H22N2O3
MOLECULAR WEIGHT: 302.36818
SMILES: CC(C)(CCC(=O)O)CCOC1=CC=CC=C1C2=CN=CN2
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Product OPENEYE NAME: 4-[[2-(1H-imidazol-5-yl)phenoxy]methyl]-1-methylsulfonyl-piperidine
CAS Name: 4-[[2-(1H-imidazol-5-yl)phenoxy]methyl]-1-methylsulfonylpiperidine
IUPAC NAME: 4-[[2-(1H-imidazol-5-yl)phenoxy]methyl]-1-methylsulfonylpiperidine
SYSTEMATIC NAME: 4-[[2-(1H-imidazol-5-yl)phenoxy]methyl]-1-methylsulfonyl-piperidine
MOLECULAR FORMULA: C16H21N3O3S
MOLECULAR WEIGHT: 335.42124
SMILES: CS(=O)(=O)N1CCC(CC1)COC2=CC=CC=C2C3=CN=CN3
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Product OPENEYE NAME: N-[3-[2-(1H-imidazol-5-yl)phenoxy]propyl]pyrimidin-2-amine
CAS Name: N-[3-[2-(1H-imidazol-5-yl)phenoxy]propyl]-2-pyrimidinamine
IUPAC NAME: N-[3-[2-(1H-imidazol-5-yl)phenoxy]propyl]pyrimidin-2-amine
SYSTEMATIC NAME: N-[3-[2-(1H-imidazol-5-yl)phenoxy]propyl]pyrimidin-2-amine
MOLECULAR FORMULA: C16H17N5O
MOLECULAR WEIGHT: 295.33908
SMILES: C1=CC=C(C(=C1)C2=CN=CN2)OCCCNC3=NC=CC=N3
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