2-[4-(4-chlorophenyl)piperazin-1-yl]-6-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]-6-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 5-benzyl-2-[4-(4-chlorophenyl)piperazin-1-yl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[4-(4-chlorophenyl)-1-piperazinyl]-6-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 5-benzyl-2-[4-(4-chlorophenyl)piperazin-1-yl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 5-benzyl-2-[4-(4-chlorophenyl)piperazino]-6-methyl-1H-pyrimidin-4-one Formula: C22H23ClN4O MolecularWeight: 394.89722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2CCN(CC2)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2CCN(CC2)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O/c1-16-20(15-17-5-3-2-4-6-17)21(28)25-22(24-16)27-13-11-26(12-14-27)19-9-7-18(23)8-10-19/h2-10H,11-15H2,1H3,(H,24,25,28)