[4-[5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[5-ethyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[5-ethyl-6-methyl-2-(3-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[5-ethyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazino]-phenyl-methanone Formula: C25H28N4O MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C3=CC=CC=C3)C4=CC(=CC=C4)C)C

Isomeric SMILES

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C3=CC=CC=C3)C4=CC(=CC=C4)C)C

InChI

InChI=1S/C25H28N4O/c1-4-22-19(3)26-23(21-12-8-9-18(2)17-21)27-24(22)28-13-15-29(16-14-28)25(30)20-10-6-5-7-11-20/h5-12,17H,4,13-16H2,1-3H3