2,5-dimethyl-N-[3-[4-(2-methylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[3-[4-(2-methylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: 2,5-dimethyl-N-[3-[4-(o-tolyl)piperazin-1-yl]-3-oxo-propyl]benzenesulfonamide CAS Name: 2,5-dimethyl-N-[3-[4-(2-methylphenyl)-1-piperazinyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: 2,5-dimethyl-N-[3-[4-(2-methylphenyl)piperazin-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: N-[3-keto-3-[4-(o-tolyl)piperazino]propyl]-2,5-dimethyl-benzenesulfonamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)N2CCN(CC2)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)N2CCN(CC2)C3=CC=CC=C3C

InChI

InChI=1S/C22H29N3O3S/c1-17-8-9-19(3)21(16-17)29(27,28)23-11-10-22(26)25-14-12-24(13-15-25)20-7-5-4-6-18(20)2/h4-9,16,23H,10-15H2,1-3H3