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

Systemtic Name: 3-methyl-2-[3-(3-methylphenyl)piperazin-1-yl]-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 3-methyl-2-[3-(m-tolyl)piperazin-1-yl]-6-(4-pyridyl)pyrimidin-4-one CAS Name: 3-methyl-2-[3-(3-methylphenyl)-1-piperazinyl]-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 3-methyl-2-[3-(3-methylphenyl)piperazin-1-yl]-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 3-methyl-2-[3-(m-tolyl)piperazino]-6-(4-pyridyl)pyrimidin-4-one Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CN(CCN2)C3=NC(=CC(=O)N3C)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2CN(CCN2)C3=NC(=CC(=O)N3C)C4=CC=NC=C4

InChI

InChI=1S/C21H23N5O/c1-15-4-3-5-17(12-15)19-14-26(11-10-23-19)21-24-18(13-20(27)25(21)2)16-6-8-22-9-7-16/h3-9,12-13,19,23H,10-11,14H2,1-2H3