3,4-dimethoxy-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]benzenesulfonamide Openeye Name: 3,4-dimethoxy-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[2-[(4-phenyl-1-piperazinyl)sulfonyl]ethyl]benzenesulfonamide IUPAC Name: 3,4-dimethoxy-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]benzenesulfonamide Traditional Name: 3,4-dimethoxy-N-[2-(4-phenylpiperazino)sulfonylethyl]benzenesulfonamide Formula: C20H27N3O6S2 MolecularWeight: 469.57488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H27N3O6S2/c1-28-19-9-8-18(16-20(19)29-2)31(26,27)21-10-15-30(24,25)23-13-11-22(12-14-23)17-6-4-3-5-7-17/h3-9,16,21H,10-15H2,1-2H3