4-bromanyl-N-(2-pyridin-1-ium-2-ylsulfanylethyl)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-(2-pyridin-1-ium-2-ylsulfanylethyl)benzenesulfonamide Openeye Name: 4-bromo-N-(2-pyridin-1-ium-2-ylsulfanylethyl)benzenesulfonamide CAS Name: 4-bromo-N-[2-(2-pyridin-1-iumylthio)ethyl]benzenesulfonamide IUPAC Name: 4-bromo-N-(2-pyridin-1-ium-2-ylsulfanylethyl)benzenesulfonamide Traditional Name: 4-bromo-N-[2-(pyridin-1-ium-2-ylthio)ethyl]benzenesulfonamide Formula: C13H14BrN2O2S2+ MolecularWeight: 374.29646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)SCCNS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=[NH+]C(=C1)SCCNS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H13BrN2O2S2/c14-11-4-6-12(7-5-11)20(17,18)16-9-10-19-13-3-1-2-8-15-13/h1-8,16H,9-10H2/p+1