2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Formula: C15H17N3O4S2 MolecularWeight: 367.44318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)[O-]

InChI

InChI=1S/C15H17N3O4S2/c16-24(21,22)13-6-4-12(5-7-13)8-9-17-14(19)11-23-15-3-1-2-10-18(15)20/h1-7,10H,8-9,11H2,(H,17,19)(H2,16,21,22)