3,4-dimethyl-N-[4-oxidanylidene-4-[4-(phenylsulfonylamino)piperidin-1-yl]butyl]benzenesulfonamide

Systemtic Name: 3,4-dimethyl-N-[4-oxidanylidene-4-[4-(phenylsulfonylamino)piperidin-1-yl]butyl]benzenesulfonamide Openeye Name: N-[4-[4-(benzenesulfonamido)-1-piperidyl]-4-oxo-butyl]-3,4-dimethyl-benzenesulfonamide CAS Name: N-[4-[4-(benzenesulfonamido)-1-piperidinyl]-4-oxobutyl]-3,4-dimethylbenzenesulfonamide IUPAC Name: N-[4-[4-(benzenesulfonamido)piperidin-1-yl]-4-oxobutyl]-3,4-dimethylbenzenesulfonamide Traditional Name: N-[4-[4-(benzenesulfonamido)piperidino]-4-keto-butyl]-3,4-dimethyl-benzenesulfonamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C23H31N3O5S2/c1-18-10-11-22(17-19(18)2)32(28,29)24-14-6-9-23(27)26-15-12-20(13-16-26)25-33(30,31)21-7-4-3-5-8-21/h3-5,7-8,10-11,17,20,24-25H,6,9,12-16H2,1-2H3