N-[3-[4-(4-ethanoylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-3-methyl-benzenesulfonamide

Systemtic Name: N-[3-[4-(4-ethanoylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-3-methyl-benzenesulfonamide Openeye Name: N-[3-[4-(4-acetylphenyl)piperazin-1-yl]-3-oxo-propyl]-3-methyl-benzenesulfonamide CAS Name: N-[3-[4-(4-acetylphenyl)-1-piperazinyl]-3-oxopropyl]-3-methylbenzenesulfonamide IUPAC Name: N-[3-[4-(4-acetylphenyl)piperazin-1-yl]-3-oxopropyl]-3-methylbenzenesulfonamide Traditional Name: N-[3-[4-(4-acetylphenyl)piperazino]-3-keto-propyl]-3-methyl-benzenesulfonamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4S/c1-17-4-3-5-21(16-17)30(28,29)23-11-10-22(27)25-14-12-24(13-15-25)20-8-6-19(7-9-20)18(2)26/h3-9,16,23H,10-15H2,1-2H3