3,4-dimethyl-N-[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butyl]benzenesulfonamide

Systemtic Name: 3,4-dimethyl-N-[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butyl]benzenesulfonamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)-4-oxo-butyl]-3,4-dimethyl-benzenesulfonamide CAS Name: 3,4-dimethyl-N-[4-oxo-4-[4-(phenylmethyl)-1-piperazinyl]butyl]benzenesulfonamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)-4-oxobutyl]-3,4-dimethylbenzenesulfonamide Traditional Name: N-[4-(4-benzylpiperazino)-4-keto-butyl]-3,4-dimethyl-benzenesulfonamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)N2CCN(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)N2CCN(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C23H31N3O3S/c1-19-10-11-22(17-20(19)2)30(28,29)24-12-6-9-23(27)26-15-13-25(14-16-26)18-21-7-4-3-5-8-21/h3-5,7-8,10-11,17,24H,6,9,12-16,18H2,1-2H3