1-[4-[5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-2-phenyl-butan-1-one

Systemtic Name: 1-[4-[5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-2-phenyl-butan-1-one Openeye Name: 1-[4-[5,6-dimethyl-2-(p-tolyl)pyrimidin-4-yl]piperazin-1-yl]-2-phenyl-butan-1-one CAS Name: 1-[4-[5,6-dimethyl-2-(4-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]-2-phenyl-1-butanone IUPAC Name: 1-[4-[5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-2-phenylbutan-1-one Traditional Name: 1-[4-[5,6-dimethyl-2-(p-tolyl)pyrimidin-4-yl]piperazino]-2-phenyl-butan-1-one Formula: C27H32N4O MolecularWeight: 428.56918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NC(=NC(=C3C)C)C4=CC=C(C=C4)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NC(=NC(=C3C)C)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H32N4O/c1-5-24(22-9-7-6-8-10-22)27(32)31-17-15-30(16-18-31)26-20(3)21(4)28-25(29-26)23-13-11-19(2)12-14-23/h6-14,24H,5,15-18H2,1-4H3