N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-N-(4-fluorophenyl)-2-methoxy-5-methyl-benzenesulfonamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-N-(4-fluorophenyl)-2-methoxy-5-methyl-benzenesulfonamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-N-(4-fluorophenyl)-2-methoxy-5-methyl-benzenesulfonamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)-2-oxoethyl]-N-(4-fluorophenyl)-2-methoxy-5-methylbenzenesulfonamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxoethyl]-N-(4-fluorophenyl)-2-methoxy-5-methylbenzenesulfonamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-2-keto-ethyl]-N-(4-fluorophenyl)-2-methoxy-5-methyl-benzenesulfonamide Formula: C22H29FN3O4S+ MolecularWeight: 450.546763

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=C(C=CC(=C3)C)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=C(C=CC(=C3)C)OC

InChI

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