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

Systemtic Name: 4-methyl-3-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]benzoic acid Openeye Name: 4-methyl-3-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)amino]benzoic acid CAS Name: 4-methyl-3-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]benzoic acid IUPAC Name: 4-methyl-3-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]benzoic acid Traditional Name: 4-methyl-3-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)amino]benzoic acid Formula: C10H9N3O2S2 MolecularWeight: 267.32736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC2=NNC(=S)S2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC2=NNC(=S)S2

InChI

InChI=1S/C10H9N3O2S2/c1-5-2-3-6(8(14)15)4-7(5)11-9-12-13-10(16)17-9/h2-4H,1H3,(H,11,12)(H,13,16)(H,14,15)