3,4-dimethoxy-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3,4-dimethoxy-N-(2-oxo-2-piperazin-1-yl-ethyl)benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[2-oxo-2-(1-piperazinyl)ethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3,4-dimethoxy-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide Traditional Name: N-benzyl-N-(2-keto-2-piperazino-ethyl)-3,4-dimethoxy-benzenesulfonamide Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)N3CCNCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)N3CCNCC3)OC

InChI

InChI=1S/C21H27N3O5S/c1-28-19-9-8-18(14-20(19)29-2)30(26,27)24(15-17-6-4-3-5-7-17)16-21(25)23-12-10-22-11-13-23/h3-9,14,22H,10-13,15-16H2,1-2H3