Saturday, January 5, 2013

All Chemical Compounds Information



Product OPENEYE NAME: 3-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl-methyl-amino]propanenitrile
CAS Name: 3-[methyl-[[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-yl-1-cyclohex-2-enyl]methyl]amino]propanenitrile
IUPAC NAME: 3-[methyl-[[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]amino]propanenitrile
SYSTEMATIC NAME: 3-[methyl-[[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-yl-cyclohex-2-en-1-yl]methyl]amino]propanenitrile
MOLECULAR FORMULA: C19H30N4O
MOLECULAR WEIGHT: 330.4677
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C)C(C)C)CN(C)CCC#N
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Product OPENEYE NAME: 2-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-5-methyl-1,3,4-oxadiazole
CAS Name: 2-methyl-5-[[(1S,4S,5S)-2-methyl-4-[(4-methyl-1-piperazinyl)methyl]-5-propan-2-yl-1-cyclohex-2-enyl]methyl]-1,3,4-oxadiazole
IUPAC NAME: 2-methyl-5-[[(1S,4S,5S)-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]-5-propan-2-ylcyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-methyl-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-oxadiazole
MOLECULAR FORMULA: C20H34N4O
MOLECULAR WEIGHT: 346.51016
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C)C(C)C)CN3CCN(CC3)C
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Product OPENEYE NAME: 4-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]morpholine
CAS Name: 4-[[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-yl-1-cyclohex-2-enyl]methyl]morpholine
IUPAC NAME: 4-[[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]morpholine
SYSTEMATIC NAME: 4-[[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-yl-cyclohex-2-en-1-yl]methyl]morpholine
MOLECULAR FORMULA: C19H31N3O2
MOLECULAR WEIGHT: 333.46834
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C)C(C)C)CN3CCOCC3
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Product OPENEYE NAME: 1-[(1S,4S,6S)-6-isopropyl-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]-N-(3-pyridylmethyl)methanamine
CAS Name: 1-[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-yl-1-cyclohex-2-enyl]-N-(3-pyridinylmethyl)methanamine
IUPAC NAME: 1-[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-ylcyclohex-2-en-1-yl]-N-(pyridin-3-ylmethyl)methanamine
SYSTEMATIC NAME: 1-[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-yl-cyclohex-2-en-1-yl]-N-(pyridin-3-ylmethyl)methanamine
MOLECULAR FORMULA: C21H30N4O
MOLECULAR WEIGHT: 354.4891
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C)C(C)C)CNCC3=CN=CC=C3
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Product OPENEYE NAME: 1-[(1S,4S,6S)-6-isopropyl-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]-N-(4-pyridylmethyl)methanamine
CAS Name: 1-[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-yl-1-cyclohex-2-enyl]-N-(pyridin-4-ylmethyl)methanamine
IUPAC NAME: 1-[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-ylcyclohex-2-en-1-yl]-N-(pyridin-4-ylmethyl)methanamine
SYSTEMATIC NAME: 1-[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-yl-cyclohex-2-en-1-yl]-N-(pyridin-4-ylmethyl)methanamine
MOLECULAR FORMULA: C21H30N4O
MOLECULAR WEIGHT: 354.4891
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C)C(C)C)CNCC3=CC=NC=C3
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Product OPENEYE NAME: [(2S)-1-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]pyrrolidin-2-yl]methanol
CAS Name: [(2S)-1-[[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-yl-1-cyclohex-2-enyl]methyl]-2-pyrrolidinyl]methanol
IUPAC NAME: [(2S)-1-[[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]pyrrolidin-2-yl]methanol
SYSTEMATIC NAME: [(2S)-1-[[(1S,4S,6S)-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-6-propan-2-yl-cyclohex-2-en-1-yl]methyl]pyrrolidin-2-yl]methanol
MOLECULAR FORMULA: C20H33N3O2
MOLECULAR WEIGHT: 347.49492
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C)C(C)C)CN3CCC[C@H]3CO
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Product OPENEYE NAME: 2-[[(1S,4S,5S)-5-isopropyl-2-methyl-4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-5-methyl-1,3,4-oxadiazole
CAS Name: 2-methyl-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-methyl-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-methyl-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: C23H34N6O
MOLECULAR WEIGHT: 410.55566
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C)C(C)C)CN3CCN(CC3)C4=NC=CC=N4
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Product OPENEYE NAME: N-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]cyclohex-2-en-1-yl]methyl]-4-methoxy-benzenesulfonamide
CAS Name: 4-methoxy-N-[[(1S,4S,6S)-3-methyl-4-[2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]-6-propan-2-yl-1-cyclohex-2-enyl]methyl]benzenesulfonamide
IUPAC NAME: 4-methoxy-N-[[(1S,4S,6S)-3-methyl-4-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]benzenesulfonamide
SYSTEMATIC NAME: 4-methoxy-N-[[(1S,4S,6S)-3-methyl-4-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-6-propan-2-yl-cyclohex-2-en-1-yl]methyl]benzenesulfonamide
MOLECULAR FORMULA: C29H40N4O4S
MOLECULAR WEIGHT: 540.7173
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC(=O)N2CCN(CC2)C3=CC=CC=N3)C(C)C)CNS(=O)(=O)C4=CC=C(C=C4)OC
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Product OPENEYE NAME: 1-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]cyclohex-2-en-1-yl]methyl]-3-(3-methoxyphenyl)urea
CAS Name: 1-(3-methoxyphenyl)-3-[[(1S,4S,6S)-3-methyl-4-[2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]-6-propan-2-yl-1-cyclohex-2-enyl]methyl]urea
IUPAC NAME: 1-(3-methoxyphenyl)-3-[[(1S,4S,6S)-3-methyl-4-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]urea
SYSTEMATIC NAME: 1-(3-methoxyphenyl)-3-[[(1S,4S,6S)-3-methyl-4-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-6-propan-2-yl-cyclohex-2-en-1-yl]methyl]urea
MOLECULAR FORMULA: C30H41N5O3
MOLECULAR WEIGHT: 519.67824
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC(=O)N2CCN(CC2)C3=CC=CC=N3)C(C)C)CNC(=O)NC4=CC(=CC=C4)OC
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