4-bromanyl-N-[(4-chlorophenyl)methyl]-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[(4-chlorophenyl)methyl]-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: 4-bromo-N-[(4-chlorophenyl)methyl]-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]benzenesulfonamide CAS Name: 4-bromo-N-[(4-chlorophenyl)methyl]-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[(4-chlorophenyl)methyl]-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: 4-bromo-N-(4-chlorobenzyl)-N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]benzenesulfonamide Formula: C20H24BrClN3O3S+ MolecularWeight: 501.84486

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN(CC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN(CC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H23BrClN3O3S/c1-23-10-12-24(13-11-23)20(26)15-25(14-16-2-6-18(22)7-3-16)29(27,28)19-8-4-17(21)5-9-19/h2-9H,10-15H2,1H3/p+1