N-(3,5-dimethylphenyl)-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: N-(3,5-dimethylphenyl)-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: N-(3,5-dimethylphenyl)-N-[2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]benzenesulfonamide CAS Name: N-(3,5-dimethylphenyl)-N-[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]benzenesulfonamide IUPAC Name: N-(3,5-dimethylphenyl)-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]benzenesulfonamide Traditional Name: N-(3,5-dimethylphenyl)-N-[2-keto-2-(4-tosylpiperazino)ethyl]benzenesulfonamide Formula: C27H31N3O5S2 MolecularWeight: 541.68214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C3=CC(=CC(=C3)C)C)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C3=CC(=CC(=C3)C)C)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O5S2/c1-21-9-11-26(12-10-21)36(32,33)29-15-13-28(14-16-29)27(31)20-30(24-18-22(2)17-23(3)19-24)37(34,35)25-7-5-4-6-8-25/h4-12,17-19H,13-16,20H2,1-3H3