4-ethoxy-N-ethyl-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: 4-ethoxy-N-ethyl-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: 4-ethoxy-N-ethyl-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]benzenesulfonamide CAS Name: 4-ethoxy-N-ethyl-N-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl]benzenesulfonamide IUPAC Name: 4-ethoxy-N-ethyl-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]benzenesulfonamide Traditional Name: 4-ethoxy-N-ethyl-N-[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethyl]benzenesulfonamide Formula: C22H28FN3O4S MolecularWeight: 449.538823

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)N1CCN(CC1)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCN(CC(=O)N1CCN(CC1)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C22H28FN3O4S/c1-3-26(31(28,29)21-11-9-20(10-12-21)30-4-2)17-22(27)25-15-13-24(14-16-25)19-7-5-18(23)6-8-19/h5-12H,3-4,13-17H2,1-2H3