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

Systemtic Name: N-(2,3-dimethylphenyl)-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: N-(2,3-dimethylphenyl)-N-[2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]benzenesulfonamide CAS Name: N-(2,3-dimethylphenyl)-N-[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]benzenesulfonamide IUPAC Name: N-(2,3-dimethylphenyl)-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]benzenesulfonamide Traditional Name: N-(2,3-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(=C3C)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(=C3C)C)S(=O)(=O)C4=CC=CC=C4

InChI

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