4-methyl-2-(4-methylphenyl)-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-methyl-2-(4-methylphenyl)-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine Openeye Name: 4-methyl-6-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-(p-tolyl)pyrimidine CAS Name: 4-methyl-2-(4-methylphenyl)-6-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]pyrimidine IUPAC Name: 4-methyl-2-(4-methylphenyl)-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine Traditional Name: 4-methyl-6-[4-(2-naphthylsulfonyl)piperazino]-2-(p-tolyl)pyrimidine Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N4O2S/c1-19-7-9-22(10-8-19)26-27-20(2)17-25(28-26)29-13-15-30(16-14-29)33(31,32)24-12-11-21-5-3-4-6-23(21)18-24/h3-12,17-18H,13-16H2,1-2H3