6-(4-methylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-1H-pyrimidin-4-one

Systemtic Name: 6-(4-methylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-1H-pyrimidin-4-one Openeye Name: 2-(4-methylpiperazin-4-ium-1-yl)-6-(p-tolyl)-1H-pyrimidin-4-one CAS Name: 6-(4-methylphenyl)-2-(4-methyl-1-piperazin-4-iumyl)-1H-pyrimidin-4-one IUPAC Name: 6-(4-methylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-1H-pyrimidin-4-one Traditional Name: 2-(4-methylpiperazin-4-ium-1-yl)-6-(p-tolyl)-1H-pyrimidin-4-one Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=O)N=C(N2)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=O)N=C(N2)N3CC[NH+](CC3)C

InChI

InChI=1S/C16H20N4O/c1-12-3-5-13(6-4-12)14-11-15(21)18-16(17-14)20-9-7-19(2)8-10-20/h3-6,11H,7-10H2,1-2H3,(H,17,18,21)/p+1