2-[4-(diphenylmethyl)piperazin-1-yl]-6-(2-methylphenyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]-6-(2-methylphenyl)-1H-pyrimidin-4-one Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)-6-(o-tolyl)-1H-pyrimidin-4-one CAS Name: 2-[4-(diphenylmethyl)-1-piperazinyl]-6-(2-methylphenyl)-1H-pyrimidin-4-one IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)-6-(2-methylphenyl)-1H-pyrimidin-4-one Traditional Name: 2-(4-benzhydrylpiperazino)-6-(o-tolyl)-1H-pyrimidin-4-one Formula: C28H28N4O MolecularWeight: 436.54812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=O)N=C(N2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=O)N=C(N2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O/c1-21-10-8-9-15-24(21)25-20-26(33)30-28(29-25)32-18-16-31(17-19-32)27(22-11-4-2-5-12-22)23-13-6-3-7-14-23/h2-15,20,27H,16-19H2,1H3,(H,29,30,33)