1-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]butan-1-one

Systemtic Name: 1-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]butan-1-one Openeye Name: 1-[4-[6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]butan-1-one CAS Name: 1-[4-[6-methyl-2-(3-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]-1-butanone IUPAC Name: 1-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]butan-1-one Traditional Name: 1-[4-[6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazino]butan-1-one Formula: C20H26N4O MolecularWeight: 338.44664

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C)C3=CC(=CC=C3)C

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C)C3=CC(=CC=C3)C

InChI

InChI=1S/C20H26N4O/c1-4-6-19(25)24-11-9-23(10-12-24)18-14-16(3)21-20(22-18)17-8-5-7-15(2)13-17/h5,7-8,13-14H,4,6,9-12H2,1-3H3