cyclohexyl-[4-[6-methyl-2-(4-methylphenyl)-5-(phenylmethyl)pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: cyclohexyl-[4-[6-methyl-2-(4-methylphenyl)-5-(phenylmethyl)pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: [4-[5-benzyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazin-1-yl]-cyclohexyl-methanone CAS Name: cyclohexyl-[4-[6-methyl-2-(4-methylphenyl)-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: [4-[5-benzyl-6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-cyclohexylmethanone Traditional Name: [4-[5-benzyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazino]-cyclohexyl-methanone Formula: C30H36N4O MolecularWeight: 468.63304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)C4CCCCC4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)C4CCCCC4)CC5=CC=CC=C5)C

InChI

InChI=1S/C30H36N4O/c1-22-13-15-25(16-14-22)28-31-23(2)27(21-24-9-5-3-6-10-24)29(32-28)33-17-19-34(20-18-33)30(35)26-11-7-4-8-12-26/h3,5-6,9-10,13-16,26H,4,7-8,11-12,17-21H2,1-2H3