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

Systemtic Name: 1-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]octan-1-one Openeye Name: 1-[4-[6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]octan-1-one CAS Name: 1-[4-[6-methyl-2-(3-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]-1-octanone IUPAC Name: 1-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]octan-1-one Traditional Name: 1-[4-[6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazino]octan-1-one Formula: C24H34N4O MolecularWeight: 394.55296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H34N4O/c1-4-5-6-7-8-12-23(29)28-15-13-27(14-16-28)22-18-20(3)25-24(26-22)21-11-9-10-19(2)17-21/h9-11,17-18H,4-8,12-16H2,1-3H3