N-(2-fluorophenyl)-N-[2-(4-methanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]-3,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-(2-fluorophenyl)-N-[2-(4-methanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-(2-fluorophenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxo-ethyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-(2-fluorophenyl)-N-[2-(4-formyl-1-piperazinyl)-2-oxoethyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-(2-fluorophenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxoethyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-(2-fluorophenyl)-N-[2-(4-formylpiperazino)-2-keto-ethyl]-3,4-dimethoxy-benzenesulfonamide Formula: C21H24FN3O6S MolecularWeight: 465.495163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)N2CCN(CC2)C=O)C3=CC=CC=C3F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)N2CCN(CC2)C=O)C3=CC=CC=C3F)OC

InChI

InChI=1S/C21H24FN3O6S/c1-30-19-8-7-16(13-20(19)31-2)32(28,29)25(18-6-4-3-5-17(18)22)14-21(27)24-11-9-23(15-26)10-12-24/h3-8,13,15H,9-12,14H2,1-2H3