5-ethyl-4-methyl-2-(3-methylphenyl)-6-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidine

Systemtic Name: 5-ethyl-4-methyl-2-(3-methylphenyl)-6-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidine Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-5-ethyl-6-methyl-2-(m-tolyl)pyrimidine CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidine IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidine Traditional Name: 4-(4-besylpiperazino)-5-ethyl-6-methyl-2-(m-tolyl)pyrimidine Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4=CC(=CC=C4)C)C

Isomeric SMILES

CCC1=C(N=C(N=C1N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4=CC(=CC=C4)C)C

InChI

InChI=1S/C24H28N4O2S/c1-4-22-19(3)25-23(20-10-8-9-18(2)17-20)26-24(22)27-13-15-28(16-14-27)31(29,30)21-11-6-5-7-12-21/h5-12,17H,4,13-16H2,1-3H3