5,6-dimethyl-2-[2-(4-methylphenyl)-1-piperazin-1-yl-propyl]-3-(phenylmethyl)pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[2-(4-methylphenyl)-1-piperazin-1-yl-propyl]-3-(phenylmethyl)pyrimidin-4-one Openeye Name: 3-benzyl-5,6-dimethyl-2-[1-piperazin-1-yl-2-(p-tolyl)propyl]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[2-(4-methylphenyl)-1-(1-piperazinyl)propyl]-3-(phenylmethyl)-4-pyrimidinone IUPAC Name: 3-benzyl-5,6-dimethyl-2-[2-(4-methylphenyl)-1-piperazin-1-ylpropyl]pyrimidin-4-one Traditional Name: 3-benzyl-5,6-dimethyl-2-[1-piperazino-2-(p-tolyl)propyl]pyrimidin-4-one Formula: C27H34N4O MolecularWeight: 430.58506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)C(C2=NC(=C(C(=O)N2CC3=CC=CC=C3)C)C)N4CCNCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(C)C(C2=NC(=C(C(=O)N2CC3=CC=CC=C3)C)C)N4CCNCC4

InChI

InChI=1S/C27H34N4O/c1-19-10-12-24(13-11-19)21(3)25(30-16-14-28-15-17-30)26-29-22(4)20(2)27(32)31(26)18-23-8-6-5-7-9-23/h5-13,21,25,28H,14-18H2,1-4H3