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

Systemtic Name: 2-(4-chlorophenyl)-4,5-dimethyl-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine Openeye Name: 2-(4-chlorophenyl)-4,5-dimethyl-6-[4-(2-naphthylsulfonyl)piperazin-1-yl]pyrimidine CAS Name: 2-(4-chlorophenyl)-4,5-dimethyl-6-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]pyrimidine IUPAC Name: 2-(4-chlorophenyl)-4,5-dimethyl-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine Traditional Name: 2-(4-chlorophenyl)-4,5-dimethyl-6-[4-(2-naphthylsulfonyl)piperazino]pyrimidine Formula: C26H25ClN4O2S MolecularWeight: 493.0203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C5=CC=C(C=C5)Cl)C

Isomeric SMILES

CC1=C(N=C(N=C1N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C5=CC=C(C=C5)Cl)C

InChI

InChI=1S/C26H25ClN4O2S/c1-18-19(2)28-25(21-7-10-23(27)11-8-21)29-26(18)30-13-15-31(16-14-30)34(32,33)24-12-9-20-5-3-4-6-22(20)17-24/h3-12,17H,13-16H2,1-2H3