3,4-dimethyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]benzenesulfonamide

Systemtic Name: 3,4-dimethyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]benzenesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-3,4-dimethyl-benzenesulfonamide CAS Name: 3,4-dimethyl-N-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]benzenesulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-3,4-dimethylbenzenesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-2-keto-ethyl]-3,4-dimethyl-benzenesulfonamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O3S/c1-17-8-9-20(14-18(17)2)28(26,27)22-15-21(25)24-12-10-23(11-13-24)16-19-6-4-3-5-7-19/h3-9,14,22H,10-13,15-16H2,1-2H3