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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CN=C(N=C2C3CCN(CC3)C(=O)CC4=CCCCC4)C5=CC=NC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C2=CN=C(N=C2C3CCN(CC3)C(=O)CC4=CCCCC4)C5=CC=NC=C5

InChI

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