N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[5-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-methyl-benzenesulfonamide Formula: C19H25ClN3O2S+ MolecularWeight: 394.9387

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H24ClN3O2S/c1-3-22-10-12-23(13-11-22)19-9-6-16(20)14-18(19)21-26(24,25)17-7-4-15(2)5-8-17/h4-9,14,21H,3,10-13H2,1-2H3/p+1