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

Systemtic Name: 1-[4-[5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[4-[5,6-dimethyl-2-(p-tolyl)pyrimidin-4-yl]piperazin-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[4-[5,6-dimethyl-2-(4-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]-3-phenyl-1-propanone IUPAC Name: 1-[4-[5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[4-[5,6-dimethyl-2-(p-tolyl)pyrimidin-4-yl]piperazino]-3-phenyl-propan-1-one Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)CCC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)CCC4=CC=CC=C4)C)C

InChI

InChI=1S/C26H30N4O/c1-19-9-12-23(13-10-19)25-27-21(3)20(2)26(28-25)30-17-15-29(16-18-30)24(31)14-11-22-7-5-4-6-8-22/h4-10,12-13H,11,14-18H2,1-3H3