4-(4-chlorophenyl)sulfanyl-2-(4-methylphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-2-(4-methylphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine Openeye Name: 4-(4-chlorophenyl)sulfanyl-6-(4-methylpiperazin-1-yl)-2-(p-tolyl)pyrimidine CAS Name: 4-[(4-chlorophenyl)thio]-2-(4-methylphenyl)-6-(4-methyl-1-piperazinyl)pyrimidine IUPAC Name: 4-(4-chlorophenyl)sulfanyl-2-(4-methylphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine Traditional Name: 4-[(4-chlorophenyl)thio]-6-(4-methylpiperazino)-2-(p-tolyl)pyrimidine Formula: C22H23ClN4S MolecularWeight: 410.96282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CC(=N2)SC3=CC=C(C=C3)Cl)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CC(=N2)SC3=CC=C(C=C3)Cl)N4CCN(CC4)C

InChI

InChI=1S/C22H23ClN4S/c1-16-3-5-17(6-4-16)22-24-20(27-13-11-26(2)12-14-27)15-21(25-22)28-19-9-7-18(23)8-10-19/h3-10,15H,11-14H2,1-2H3