2-[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]sulfanylbenzoic acid

Systemtic Name: 2-[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]sulfanylbenzoic acid Openeye Name: 2-[1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanylbenzoic acid CAS Name: 2-[[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]thio]benzoic acid IUPAC Name: 2-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]sulfanylbenzoic acid Traditional Name: 2-[[2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl]thio]benzoic acid Formula: C16H16N2O5S2 MolecularWeight: 380.43864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H16N2O5S2/c1-10(24-14-5-3-2-4-13(14)16(20)21)15(19)18-11-6-8-12(9-7-11)25(17,22)23/h2-10H,1H3,(H,18,19)(H,20,21)(H2,17,22,23)