4,5-dimethyl-2-(4-methylphenyl)-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine

Systemtic Name: 4,5-dimethyl-2-(4-methylphenyl)-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine Openeye Name: 4,5-dimethyl-6-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-(p-tolyl)pyrimidine CAS Name: 4,5-dimethyl-2-(4-methylphenyl)-6-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]pyrimidine IUPAC Name: 4,5-dimethyl-2-(4-methylphenyl)-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine Traditional Name: 4,5-dimethyl-6-[4-(2-naphthylsulfonyl)piperazino]-2-(p-tolyl)pyrimidine Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C)C

InChI

InChI=1S/C27H28N4O2S/c1-19-8-10-23(11-9-19)26-28-21(3)20(2)27(29-26)30-14-16-31(17-15-30)34(32,33)25-13-12-22-6-4-5-7-24(22)18-25/h4-13,18H,14-17H2,1-3H3