4-(1,3,4-thiadiazol-2-ylsulfanylmethyl)benzoic acid

Systemtic Name: 4-(1,3,4-thiadiazol-2-ylsulfanylmethyl)benzoic acid Openeye Name: 4-(1,3,4-thiadiazol-2-ylsulfanylmethyl)benzoic acid CAS Name: 4-[(1,3,4-thiadiazol-2-ylthio)methyl]benzoic acid IUPAC Name: 4-(1,3,4-thiadiazol-2-ylsulfanylmethyl)benzoic acid Traditional Name: 4-[(1,3,4-thiadiazol-2-ylthio)methyl]benzoic acid Formula: C10H8N2O2S2 MolecularWeight: 252.31272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NN=CS2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CSC2=NN=CS2)C(=O)O

InChI

InChI=1S/C10H8N2O2S2/c13-9(14)8-3-1-7(2-4-8)5-15-10-12-11-6-16-10/h1-4,6H,5H2,(H,13,14)