Sunday, January 6, 2013

All Chemical Compounds Information



Product OPENEYE NAME: 2-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-(pyrrolidin-1-ylmethyl)cyclohex-2-en-1-yl]methyl]-5-(3-methylimidazol-4-yl)-1,3,4-oxadiazole
CAS Name: 2-(3-methyl-4-imidazolyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-(1-pyrrolidinylmethyl)-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazole
IUPAC NAME: 2-(3-methylimidazol-4-yl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-(pyrrolidin-1-ylmethyl)cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-(3-methylimidazol-4-yl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-(pyrrolidin-1-ylmethyl)cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
MOLECULAR FORMULA: C22H33N5O
MOLECULAR WEIGHT: 383.53032
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CN4CCCC4
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Product OPENEYE NAME: N'-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]methyl]-N,N,N'-trimethyl-ethane-1,2-diamine
CAS Name: N,N,N'-trimethyl-N'-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methyl-4-imidazolyl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-1-cyclohex-2-enyl]methyl]ethane-1,2-diamine
IUPAC NAME: N,N,N'-trimethyl-N'-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]ethane-1,2-diamine
SYSTEMATIC NAME: N,N,N'-trimethyl-N'-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-cyclohex-2-en-1-yl]methyl]ethane-1,2-diamine
MOLECULAR FORMULA: C23H38N6O
MOLECULAR WEIGHT: 414.58742
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CN(C)CCN(C)C
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Product OPENEYE NAME: 2-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[[4-(2-pyridyl)piperazin-1-yl]methyl]cyclohex-2-en-1-yl]methyl]-5-(3-methylimidazol-4-yl)-1,3,4-oxadiazole
CAS Name: 2-(3-methyl-4-imidazolyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazole
IUPAC NAME: 2-(3-methylimidazol-4-yl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-(3-methylimidazol-4-yl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
MOLECULAR FORMULA: C27H37N7O
MOLECULAR WEIGHT: 475.62898
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CN4CCN(CC4)C5=CC=CC=N5
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Product OPENEYE NAME: 1-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]methyl]piperidine-4-carboxamide
CAS Name: 1-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methyl-4-imidazolyl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-1-cyclohex-2-enyl]methyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-cyclohex-2-en-1-yl]methyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C24H36N6O2
MOLECULAR WEIGHT: 440.58164
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CN4CCC(CC4)C(=O)N
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Product OPENEYE NAME: 2-[[(1S,4S,5S)-4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-5-isopropyl-2-methyl-cyclohex-2-en-1-yl]methyl]-5-(3-methylimidazol-4-yl)-1,3,4-oxadiazole
CAS Name: 2-[[(1S,4S,5S)-4-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-2-methyl-5-propan-2-yl-1-cyclohex-2-enyl]methyl]-5-(3-methyl-4-imidazolyl)-1,3,4-oxadiazole
IUPAC NAME: 2-[[(1S,4S,5S)-4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-2-methyl-5-propan-2-ylcyclohex-2-en-1-yl]methyl]-5-(3-methylimidazol-4-yl)-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-[[(1S,4S,5S)-4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-2-methyl-5-propan-2-yl-cyclohex-2-en-1-yl]methyl]-5-(3-methylimidazol-4-yl)-1,3,4-oxadiazole
MOLECULAR FORMULA: C28H37FN6O
MOLECULAR WEIGHT: 492.631383
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CN4CCN(CC4)C5=CC=C(C=C5)F
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Product OPENEYE NAME: 1-[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]-N-methyl-N-(3-pyridylmethyl)methanamine
CAS Name: N-methyl-1-[(1S,4S,6S)-3-methyl-4-[[5-(3-methyl-4-imidazolyl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-1-cyclohex-2-enyl]-N-(3-pyridinylmethyl)methanamine
IUPAC NAME: N-methyl-1-[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-ylcyclohex-2-en-1-yl]-N-(pyridin-3-ylmethyl)methanamine
SYSTEMATIC NAME: N-methyl-1-[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-cyclohex-2-en-1-yl]-N-(pyridin-3-ylmethyl)methanamine
MOLECULAR FORMULA: C25H34N6O
MOLECULAR WEIGHT: 434.57706
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CN(C)CC4=CN=CC=C4
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Product OPENEYE NAME: 4-[[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]methylamino]methyl]benzonitrile
CAS Name: 4-[[[(1S,4S,6S)-3-methyl-4-[[5-(3-methyl-4-imidazolyl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-1-cyclohex-2-enyl]methylamino]methyl]benzonitrile
IUPAC NAME: 4-[[[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-ylcyclohex-2-en-1-yl]methylamino]methyl]benzonitrile
SYSTEMATIC NAME: 4-[[[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-cyclohex-2-en-1-yl]methylamino]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C26H32N6O
MOLECULAR WEIGHT: 444.57188
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CNCC4=CC=C(C=C4)C#N
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Product OPENEYE NAME: 2-[[(1S,4S,5S)-5-isopropyl-4-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]-2-methyl-cyclohex-2-en-1-yl]methyl]-5-(3-methylimidazol-4-yl)-1,3,4-oxadiazole
CAS Name: 2-[[(1S,4S,5S)-4-[[4-(2-methoxyethyl)-1-piperazinyl]methyl]-2-methyl-5-propan-2-yl-1-cyclohex-2-enyl]methyl]-5-(3-methyl-4-imidazolyl)-1,3,4-oxadiazole
IUPAC NAME: 2-[[(1S,4S,5S)-4-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]-2-methyl-5-propan-2-ylcyclohex-2-en-1-yl]methyl]-5-(3-methylimidazol-4-yl)-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-[[(1S,4S,5S)-4-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]-2-methyl-5-propan-2-yl-cyclohex-2-en-1-yl]methyl]-5-(3-methylimidazol-4-yl)-1,3,4-oxadiazole
MOLECULAR FORMULA: C25H40N6O2
MOLECULAR WEIGHT: 456.6241
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CN4CCN(CC4)CCOC
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Product OPENEYE NAME: 2-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-5-(3-methylimidazol-4-yl)-1,3,4-oxadiazole
CAS Name: 2-(3-methyl-4-imidazolyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[[4-(2-pyrazinyl)-1-piperazinyl]methyl]-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazole
IUPAC NAME: 2-(3-methylimidazol-4-yl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-(3-methylimidazol-4-yl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
MOLECULAR FORMULA: C26H36N8O
MOLECULAR WEIGHT: 476.61704
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CN4CCN(CC4)C5=NC=CN=C5
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Product OPENEYE NAME: N-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]methyl]pyridin-2-amine
CAS Name: N-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methyl-4-imidazolyl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-1-cyclohex-2-enyl]methyl]-2-pyridinamine
IUPAC NAME: N-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]pyridin-2-amine
SYSTEMATIC NAME: N-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-cyclohex-2-en-1-yl]methyl]pyridin-2-amine
MOLECULAR FORMULA: C23H30N6O
MOLECULAR WEIGHT: 406.5239
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CNC4=CC=CC=N4
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Product OPENEYE NAME: N-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]methyl]-6-methoxy-pyridin-3-amine
CAS Name: 6-methoxy-N-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methyl-4-imidazolyl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-1-cyclohex-2-enyl]methyl]-3-pyridinamine
IUPAC NAME: 6-methoxy-N-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]pyridin-3-amine
SYSTEMATIC NAME: 6-methoxy-N-[[(1S,4S,6S)-3-methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-yl-cyclohex-2-en-1-yl]methyl]pyridin-3-amine
MOLECULAR FORMULA: C24H32N6O2
MOLECULAR WEIGHT: 436.54988
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CNC4=CN=C(C=C4)OC
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Product OPENEYE NAME: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
CAS Name: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazole
IUPAC NAME: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
MOLECULAR FORMULA: C28H35FN6O
MOLECULAR WEIGHT: 490.615503
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=CC=C3F)C(C)C)CN4CCN(CC4)C5=NC=CC=N5
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Product OPENEYE NAME: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[[4-(2-pyridyl)piperazin-1-yl]methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
CAS Name: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazole
IUPAC NAME: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
MOLECULAR FORMULA: C29H36FN5O
MOLECULAR WEIGHT: 489.627443
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=CC=C3F)C(C)C)CN4CCN(CC4)C5=CC=CC=N5
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Product OPENEYE NAME: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
CAS Name: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[[4-(2-pyrazinyl)-1-piperazinyl]methyl]-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazole
IUPAC NAME: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-(2-fluorophenyl)-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
MOLECULAR FORMULA: C28H35FN6O
MOLECULAR WEIGHT: 490.615503
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=CC=C3F)C(C)C)CN4CCN(CC4)C5=NC=CN=C5
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