4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-6-methyl-2-(3-methylphenyl)pyrimidine

Systemtic Name: 4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-6-methyl-2-(3-methylphenyl)pyrimidine Openeye Name: 4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-6-methyl-2-(m-tolyl)pyrimidine CAS Name: 4-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-6-methyl-2-(3-methylphenyl)pyrimidine IUPAC Name: 4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-6-methyl-2-(3-methylphenyl)pyrimidine Traditional Name: 4-[4-(4-chlorophenyl)sulfonylpiperazino]-6-methyl-2-(m-tolyl)pyrimidine Formula: C22H23ClN4O2S MolecularWeight: 442.96162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN4O2S/c1-16-4-3-5-18(14-16)22-24-17(2)15-21(25-22)26-10-12-27(13-11-26)30(28,29)20-8-6-19(23)7-9-20/h3-9,14-15H,10-13H2,1-2H3