4-methyl-3-[(2-methylsulfanylphenyl)sulfamoyl]benzoic acid

Systemtic Name: 4-methyl-3-[(2-methylsulfanylphenyl)sulfamoyl]benzoic acid Openeye Name: 4-methyl-3-[(2-methylsulfanylphenyl)sulfamoyl]benzoic acid CAS Name: 4-methyl-3-[[2-(methylthio)phenyl]sulfamoyl]benzoic acid IUPAC Name: 4-methyl-3-[(2-methylsulfanylphenyl)sulfamoyl]benzoic acid Traditional Name: 4-methyl-3-[[2-(methylthio)phenyl]sulfamoyl]benzoic acid Formula: C15H15NO4S2 MolecularWeight: 337.4139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2SC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2SC

InChI

InChI=1S/C15H15NO4S2/c1-10-7-8-11(15(17)18)9-14(10)22(19,20)16-12-5-3-4-6-13(12)21-2/h3-9,16H,1-2H3,(H,17,18)