3-[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonylamino]benzoic acid

Systemtic Name: 3-[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonylamino]benzoic acid Openeye Name: 3-[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonylamino]benzoic acid CAS Name: 3-[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonylamino]benzoic acid IUPAC Name: 3-[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonylamino]benzoic acid Traditional Name: 3-[(5-methylpiazthiol-4-yl)sulfonylamino]benzoic acid Formula: C14H11N3O4S2 MolecularWeight: 349.38484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NSN=C2C=C1)S(=O)(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=C(C2=NSN=C2C=C1)S(=O)(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C14H11N3O4S2/c1-8-5-6-11-12(16-22-15-11)13(8)23(20,21)17-10-4-2-3-9(7-10)14(18)19/h2-7,17H,1H3,(H,18,19)