3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-(4-methylphenyl)pyrimidin-4-one

Systemtic Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-(4-methylphenyl)pyrimidin-4-one Openeye Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-6-(p-tolyl)pyrimidin-4-one CAS Name: 3-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-6-(4-methylphenyl)-4-pyrimidinone IUPAC Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-6-(4-methylphenyl)pyrimidin-4-one Traditional Name: 3-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]-6-(p-tolyl)pyrimidin-4-one Formula: C23H23ClN4O2 MolecularWeight: 422.90732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H23ClN4O2/c1-17-5-7-18(8-6-17)21-14-22(29)28(16-25-21)15-23(30)27-11-9-26(10-12-27)20-4-2-3-19(24)13-20/h2-8,13-14,16H,9-12,15H2,1H3