N,N-dimethyl-3-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]benzenesulfonamide Openeye Name: N,N-dimethyl-3-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]benzenesulfonamide CAS Name: N,N-dimethyl-3-[[(1-oxido-2-pyridin-1-iumyl)thio]methyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-3-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]benzenesulfonamide Traditional Name: N,N-dimethyl-3-[[(1-oxidopyridin-1-ium-2-yl)thio]methyl]benzenesulfonamide Formula: C14H16N2O3S2 MolecularWeight: 324.41844

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C14H16N2O3S2/c1-15(2)21(18,19)13-7-5-6-12(10-13)11-20-14-8-3-4-9-16(14)17/h3-10H,11H2,1-2H3