4-chloranyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-4-chloro-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]benzenesulfonamide CAS Name: 4-chloro-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-4-chloro-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: N-benzyl-4-chloro-N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]benzenesulfonamide Formula: C20H25ClN3O3S+ MolecularWeight: 422.9488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24ClN3O3S/c1-22-11-13-23(14-12-22)20(25)16-24(15-17-5-3-2-4-6-17)28(26,27)19-9-7-18(21)8-10-19/h2-10H,11-16H2,1H3/p+1