(E)-1-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-1-[4-[6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one CAS Name: (E)-1-[4-[6-methyl-2-(3-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[4-[6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazino]-3-phenyl-prop-2-en-1-one Formula: C25H26N4O MolecularWeight: 398.50014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=CC(=N2)N3CCN(CC3)C(=O)C=CC4=CC=CC=C4)C

Isomeric SMILES

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

InChI

InChI=1S/C25H26N4O/c1-19-7-6-10-22(17-19)25-26-20(2)18-23(27-25)28-13-15-29(16-14-28)24(30)12-11-21-8-4-3-5-9-21/h3-12,17-18H,13-16H2,1-2H3/b12-11+