2-(4-chlorophenyl)-4,5-dimethyl-6-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidine

Systemtic Name: 2-(4-chlorophenyl)-4,5-dimethyl-6-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidine Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-2-(4-chlorophenyl)-5,6-dimethyl-pyrimidine CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-2-(4-chlorophenyl)-5,6-dimethylpyrimidine IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-2-(4-chlorophenyl)-5,6-dimethylpyrimidine Traditional Name: 4-(4-besylpiperazino)-2-(4-chlorophenyl)-5,6-dimethyl-pyrimidine Formula: C22H23ClN4O2S MolecularWeight: 442.96162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=C(N=C(N=C1N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C

InChI

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