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

Systemtic Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylethyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylethyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[2-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]ethyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylethyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[2-[4-(4-fluorophenyl)piperazino]sulfonylethyl]-3,4-dimethoxy-benzenesulfonamide Formula: C20H26FN3O6S2 MolecularWeight: 487.565343

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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=C(C=C3)F)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H26FN3O6S2/c1-29-19-8-7-18(15-20(19)30-2)32(27,28)22-9-14-31(25,26)24-12-10-23(11-13-24)17-5-3-16(21)4-6-17/h3-8,15,22H,9-14H2,1-2H3