4-(4-methylphenyl)-2-[(4-methylphenyl)methylsulfanyl]-6-(4-methylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-(4-methylphenyl)-2-[(4-methylphenyl)methylsulfanyl]-6-(4-methylpiperazin-1-yl)pyrimidine Openeye Name: 4-(4-methylpiperazin-1-yl)-6-(p-tolyl)-2-(p-tolylmethylsulfanyl)pyrimidine CAS Name: 4-(4-methylphenyl)-2-[(4-methylphenyl)methylthio]-6-(4-methyl-1-piperazinyl)pyrimidine IUPAC Name: 4-(4-methylphenyl)-2-[(4-methylphenyl)methylsulfanyl]-6-(4-methylpiperazin-1-yl)pyrimidine Traditional Name: 2-[(4-methylbenzyl)thio]-4-(4-methylpiperazino)-6-(p-tolyl)pyrimidine Formula: C24H28N4S MolecularWeight: 404.57092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC(=CC(=N2)N3CCN(CC3)C)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC(=CC(=N2)N3CCN(CC3)C)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H28N4S/c1-18-4-8-20(9-5-18)17-29-24-25-22(21-10-6-19(2)7-11-21)16-23(26-24)28-14-12-27(3)13-15-28/h4-11,16H,12-15,17H2,1-3H3