Saturday, January 5, 2013

All Chemical Compounds Information



Product OPENEYE NAME: 4-[5-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]-N,N-dimethyl-aniline
CAS Name: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-4-[(4-methyl-1-piperazinyl)methyl]-5-propan-2-yl-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazol-2-yl]aniline
IUPAC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]-5-propan-2-ylcyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
SYSTEMATIC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]-5-propan-2-yl-cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
MOLECULAR FORMULA: C27H41N5O
MOLECULAR WEIGHT: 451.64734
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=C(C=C3)N(C)C)C(C)C)CN4CCN(CC4)C
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Product OPENEYE NAME: 4-[5-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-(morpholinomethyl)cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]-N,N-dimethyl-aniline
CAS Name: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-4-(4-morpholinylmethyl)-5-propan-2-yl-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazol-2-yl]aniline
IUPAC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-4-(morpholin-4-ylmethyl)-5-propan-2-ylcyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
SYSTEMATIC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-4-(morpholin-4-ylmethyl)-5-propan-2-yl-cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
MOLECULAR FORMULA: C26H38N4O2
MOLECULAR WEIGHT: 438.60552
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=C(C=C3)N(C)C)C(C)C)CN4CCOCC4
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Product OPENEYE NAME: 4-[5-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[(2-pyridylmethylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]-N,N-dimethyl-aniline
CAS Name: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(2-pyridinylmethylamino)methyl]-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazol-2-yl]aniline
IUPAC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(pyridin-2-ylmethylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
SYSTEMATIC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(pyridin-2-ylmethylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
MOLECULAR FORMULA: C28H37N5O
MOLECULAR WEIGHT: 459.62628
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=C(C=C3)N(C)C)C(C)C)CNCC4=CC=CC=N4
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Product OPENEYE NAME: 4-[5-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[(3-pyridylmethylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]-N,N-dimethyl-aniline
CAS Name: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(3-pyridinylmethylamino)methyl]-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazol-2-yl]aniline
IUPAC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(pyridin-3-ylmethylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
SYSTEMATIC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(pyridin-3-ylmethylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
MOLECULAR FORMULA: C28H37N5O
MOLECULAR WEIGHT: 459.62628
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=C(C=C3)N(C)C)C(C)C)CNCC4=CN=CC=C4
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Product OPENEYE NAME: 4-[5-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[(4-pyridylmethylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]-N,N-dimethyl-aniline
CAS Name: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(pyridin-4-ylmethylamino)methyl]-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazol-2-yl]aniline
IUPAC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(pyridin-4-ylmethylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
SYSTEMATIC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(pyridin-4-ylmethylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
MOLECULAR FORMULA: C28H37N5O
MOLECULAR WEIGHT: 459.62628
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=C(C=C3)N(C)C)C(C)C)CNCC4=CC=NC=C4
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Product OPENEYE NAME: [(2S)-1-[[(1S,4S,6S)-4-[[5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazol-2-yl]methyl]-6-isopropyl-3-methyl-cyclohex-2-en-1-yl]methyl]pyrrolidin-2-yl]methanol
CAS Name: [(2S)-1-[[(1S,4S,6S)-4-[[5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-propan-2-yl-1-cyclohex-2-enyl]methyl]-2-pyrrolidinyl]methanol
IUPAC NAME: [(2S)-1-[[(1S,4S,6S)-4-[[5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-propan-2-ylcyclohex-2-en-1-yl]methyl]pyrrolidin-2-yl]methanol
SYSTEMATIC NAME: [(2S)-1-[[(1S,4S,6S)-4-[[5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-propan-2-yl-cyclohex-2-en-1-yl]methyl]pyrrolidin-2-yl]methanol
MOLECULAR FORMULA: C27H40N4O2
MOLECULAR WEIGHT: 452.6321
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=C(C=C3)N(C)C)C(C)C)CN4CCC[C@H]4CO
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Product OPENEYE NAME: 4-[5-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[(prop-2-ynylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]-N,N-dimethyl-aniline
CAS Name: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(prop-2-ynylamino)methyl]-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazol-2-yl]aniline
IUPAC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(prop-2-ynylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
SYSTEMATIC NAME: N,N-dimethyl-4-[5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(prop-2-ynylamino)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]aniline
MOLECULAR FORMULA: C25H34N4O
MOLECULAR WEIGHT: 406.56366
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=C(C=C3)N(C)C)C(C)C)CNCC#C
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Product OPENEYE NAME: 4-[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-oxadiazol-2-yl]-N,N-dimethyl-aniline
CAS Name: N,N-dimethyl-4-[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-oxadiazol-2-yl]aniline
IUPAC NAME: N,N-dimethyl-4-[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-oxadiazol-2-yl]aniline
SYSTEMATIC NAME: N,N-dimethyl-4-[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-oxadiazol-2-yl]aniline
MOLECULAR FORMULA: C30H41N7O
MOLECULAR WEIGHT: 515.69284
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=C(C=C3)N(C)C)C(C)C)CN4CCN(CC4)C5=NC=CC=N5
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Product OPENEYE NAME: 1-[[(1S,4S,6S)-4-[[5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazol-2-yl]methyl]-6-isopropyl-3-methyl-cyclohex-2-en-1-yl]methyl]piperidine-4-carboxamide
CAS Name: 1-[[(1S,4S,6S)-4-[[5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-propan-2-yl-1-cyclohex-2-enyl]methyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[[(1S,4S,6S)-4-[[5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-propan-2-ylcyclohex-2-en-1-yl]methyl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-[[(1S,4S,6S)-4-[[5-[4-(dimethylamino)phenyl]-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-propan-2-yl-cyclohex-2-en-1-yl]methyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C28H41N5O2
MOLECULAR WEIGHT: 479.65744
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=C(C=C3)N(C)C)C(C)C)CN4CCC(CC4)C(=O)N
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