N-(4-ethoxyphenyl)-4-fluoranyl-N-[2-(4-methanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: N-(4-ethoxyphenyl)-4-fluoranyl-N-[2-(4-methanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: N-(4-ethoxyphenyl)-4-fluoro-N-[2-(4-formylpiperazin-1-yl)-2-oxo-ethyl]benzenesulfonamide CAS Name: N-(4-ethoxyphenyl)-4-fluoro-N-[2-(4-formyl-1-piperazinyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: N-(4-ethoxyphenyl)-4-fluoro-N-[2-(4-formylpiperazin-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: 4-fluoro-N-[2-(4-formylpiperazino)-2-keto-ethyl]-N-p-phenetyl-benzenesulfonamide Formula: C21H24FN3O5S MolecularWeight: 449.495763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)N2CCN(CC2)C=O)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)N2CCN(CC2)C=O)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H24FN3O5S/c1-2-30-19-7-5-18(6-8-19)25(31(28,29)20-9-3-17(22)4-10-20)15-21(27)24-13-11-23(16-26)12-14-24/h3-10,16H,2,11-15H2,1H3