3-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfamoyl]benzoic acid

Systemtic Name: 3-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfamoyl]benzoic acid Openeye Name: 3-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfamoyl]benzoic acid CAS Name: 3-[[2-(methylthio)-1,3-benzothiazol-6-yl]sulfamoyl]benzoic acid IUPAC Name: 3-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfamoyl]benzoic acid Traditional Name: 3-[[2-(methylthio)-1,3-benzothiazol-6-yl]sulfamoyl]benzoic acid Formula: C15H12N2O4S3 MolecularWeight: 380.46178

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C15H12N2O4S3/c1-22-15-16-12-6-5-10(8-13(12)23-15)17-24(20,21)11-4-2-3-9(7-11)14(18)19/h2-8,17H,1H3,(H,18,19)