2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoyl]benzoic acid

Systemtic Name: 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoyl]benzoic acid Openeye Name: 2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoyl]benzoic acid CAS Name: 2-[oxo-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methyl]benzoic acid IUPAC Name: 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoyl]benzoic acid Traditional Name: 2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoyl]benzoic acid Formula: C10H7N3O3S2 MolecularWeight: 281.31088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=NNC(=S)S2)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=NNC(=S)S2)C(=O)O

InChI

InChI=1S/C10H7N3O3S2/c14-7(11-9-12-13-10(17)18-9)5-3-1-2-4-6(5)8(15)16/h1-4H,(H,13,17)(H,15,16)(H,11,12,14)