2-(cyclohexen-1-yl)-1-[4-[5-(2-methylphenyl)-2-pyridin-3-yl-pyrimidin-4-yl]piperidin-1-yl]ethanone

Systemtic Name: 2-(cyclohexen-1-yl)-1-[4-[5-(2-methylphenyl)-2-pyridin-3-yl-pyrimidin-4-yl]piperidin-1-yl]ethanone Openeye Name: 2-(cyclohexen-1-yl)-1-[4-[5-(o-tolyl)-2-(3-pyridyl)pyrimidin-4-yl]-1-piperidyl]ethanone CAS Name: 2-(1-cyclohexenyl)-1-[4-[5-(2-methylphenyl)-2-(3-pyridinyl)-4-pyrimidinyl]-1-piperidinyl]ethanone IUPAC Name: 2-(cyclohexen-1-yl)-1-[4-[5-(2-methylphenyl)-2-pyridin-3-ylpyrimidin-4-yl]piperidin-1-yl]ethanone Traditional Name: 2-(cyclohexen-1-yl)-1-[4-[5-(o-tolyl)-2-(3-pyridyl)pyrimidin-4-yl]piperidino]ethanone Formula: C29H32N4O MolecularWeight: 452.59058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CN=C(N=C2C3CCN(CC3)C(=O)CC4=CCCCC4)C5=CN=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C2=CN=C(N=C2C3CCN(CC3)C(=O)CC4=CCCCC4)C5=CN=CC=C5

InChI

InChI=1S/C29H32N4O/c1-21-8-5-6-12-25(21)26-20-31-29(24-11-7-15-30-19-24)32-28(26)23-13-16-33(17-14-23)27(34)18-22-9-3-2-4-10-22/h5-9,11-12,15,19-20,23H,2-4,10,13-14,16-18H2,1H3