3-cyano-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide

Systemtic Name: 3-cyano-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide Openeye Name: 3-cyano-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide CAS Name: 3-cyano-N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]benzenesulfonamide IUPAC Name: 3-cyano-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide Traditional Name: 3-cyano-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide Formula: C19H23N4O2S+ MolecularWeight: 371.47652

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H22N4O2S/c1-2-22-10-12-23(13-11-22)19-9-4-3-8-18(19)21-26(24,25)17-7-5-6-16(14-17)15-20/h3-9,14,21H,2,10-13H2,1H3/p+1