Saturday, January 5, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]methyl]-N',N'-dimethyl-ethane-1,2-diamine
CAS Name: N',N'-dimethyl-N-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]-1-cyclohex-2-enyl]methyl]ethane-1,2-diamine
IUPAC NAME: N',N'-dimethyl-N-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]ethane-1,2-diamine
SYSTEMATIC NAME: N',N'-dimethyl-N-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]ethane-1,2-diamine
MOLECULAR FORMULA: C23H35N5O
MOLECULAR WEIGHT: 397.5569
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=NC=C3)C(C)C)CNCCN(C)C
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Product OPENEYE NAME: 2-[4-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]methyl]piperazin-1-yl]ethanol
CAS Name: 2-[4-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]-1-cyclohex-2-enyl]methyl]-1-piperazinyl]ethanol
IUPAC NAME: 2-[4-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]piperazin-1-yl]ethanol
SYSTEMATIC NAME: 2-[4-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]piperazin-1-yl]ethanol
MOLECULAR FORMULA: C25H37N5O2
MOLECULAR WEIGHT: 439.59358
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=NC=C3)C(C)C)CN4CCN(CC4)CCO
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Product OPENEYE NAME: 1-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]methyl]piperidin-4-ol
CAS Name: 1-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]-1-cyclohex-2-enyl]methyl]-4-piperidinol
IUPAC NAME: 1-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]piperidin-4-ol
SYSTEMATIC NAME: 1-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]piperidin-4-ol
MOLECULAR FORMULA: C24H34N4O2
MOLECULAR WEIGHT: 410.55236
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=NC=C3)C(C)C)CN4CCC(CC4)O
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Product OPENEYE NAME: N-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]methyl]propan-2-amine
CAS Name: N-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]-1-cyclohex-2-enyl]methyl]-2-propanamine
IUPAC NAME: N-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]propan-2-amine
SYSTEMATIC NAME: N-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]propan-2-amine
MOLECULAR FORMULA: C22H32N4O
MOLECULAR WEIGHT: 368.51568
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=NC=C3)C(C)C)CNC(C)C
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Product OPENEYE NAME: N-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]methyl]-2-methoxy-ethanamine
CAS Name: 2-methoxy-N-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]-1-cyclohex-2-enyl]methyl]ethanamine
IUPAC NAME: 2-methoxy-N-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]ethanamine
SYSTEMATIC NAME: 2-methoxy-N-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]ethanamine
MOLECULAR FORMULA: C22H32N4O2
MOLECULAR WEIGHT: 384.51508
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=NC=C3)C(C)C)CNCCOC
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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-(4-pyridyl)-1,3,4-oxadiazole
CAS Name: 2-[[(1S,4S,5S)-2-methyl-4-[(4-methyl-1-piperazinyl)methyl]-5-propan-2-yl-1-cyclohex-2-enyl]methyl]-5-pyridin-4-yl-1,3,4-oxadiazole
IUPAC NAME: 2-[[(1S,4S,5S)-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]-5-propan-2-ylcyclohex-2-en-1-yl]methyl]-5-pyridin-4-yl-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-[[(1S,4S,5S)-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]-5-propan-2-yl-cyclohex-2-en-1-yl]methyl]-5-pyridin-4-yl-1,3,4-oxadiazole
MOLECULAR FORMULA: C24H35N5O
MOLECULAR WEIGHT: 409.5676
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=NC=C3)C(C)C)CN4CCN(CC4)C
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Product OPENEYE NAME: 4-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]methyl]morpholine
CAS Name: 4-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]-1-cyclohex-2-enyl]methyl]morpholine
IUPAC NAME: 4-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]morpholine
SYSTEMATIC NAME: 4-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]morpholine
MOLECULAR FORMULA: C23H32N4O2
MOLECULAR WEIGHT: 396.52578
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=NC=C3)C(C)C)CN4CCOCC4
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Product OPENEYE NAME: 1-[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]methyl]cyclohex-2-en-1-yl]-N-(3-pyridylmethyl)methanamine
CAS Name: 1-[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]-1-cyclohex-2-enyl]-N-(3-pyridinylmethyl)methanamine
IUPAC NAME: 1-[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]-N-(pyridin-3-ylmethyl)methanamine
SYSTEMATIC NAME: 1-[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]-N-(pyridin-3-ylmethyl)methanamine
MOLECULAR FORMULA: C25H31N5O
MOLECULAR WEIGHT: 417.54654
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=NC=C3)C(C)C)CNCC4=CN=CC=C4
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Product OPENEYE NAME: [(2S)-1-[[(1S,4S,6S)-6-isopropyl-3-methyl-4-[[5-(4-pyridyl)-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-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]-1-cyclohex-2-enyl]methyl]-2-pyrrolidinyl]methanol
IUPAC NAME: [(2S)-1-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]pyrrolidin-2-yl]methanol
SYSTEMATIC NAME: [(2S)-1-[[(1S,4S,6S)-3-methyl-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]pyrrolidin-2-yl]methanol
MOLECULAR FORMULA: C24H34N4O2
MOLECULAR WEIGHT: 410.55236
SMILES: CC1=C[C@H]([C@@H](C[C@H]1CC2=NN=C(O2)C3=CC=NC=C3)C(C)C)CN4CCC[C@H]4CO
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