3-ethanoyl-N-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: 3-ethanoyl-N-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: 3-acetyl-N-[3-oxo-3-[4-(p-tolylsulfonyl)piperazin-1-yl]propyl]benzenesulfonamide CAS Name: 3-acetyl-N-[3-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: 3-acetyl-N-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: 3-acetyl-N-[3-keto-3-(4-tosylpiperazino)propyl]benzenesulfonamide Formula: C22H27N3O6S2 MolecularWeight: 493.59628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O6S2/c1-17-6-8-20(9-7-17)33(30,31)25-14-12-24(13-15-25)22(27)10-11-23-32(28,29)21-5-3-4-19(16-21)18(2)26/h3-9,16,23H,10-15H2,1-2H3