2-[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-oxo-2-(4-sulfamoylanilino)ethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-keto-2-(4-sulfamoylanilino)ethyl]thio]nicotinic acid Formula: C14H13N3O5S2 MolecularWeight: 367.40012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C14H13N3O5S2/c15-24(21,22)10-5-3-9(4-6-10)17-12(18)8-23-13-11(14(19)20)2-1-7-16-13/h1-7H,8H2,(H,17,18)(H,19,20)(H2,15,21,22)