1-(2-methylsulfanylphenyl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(2-methylsulfanylphenyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(2-methylsulfanylphenyl)triazole-4-carboxylic acid CAS Name: 1-[2-(methylthio)phenyl]-4-triazolecarboxylic acid IUPAC Name: 1-(2-methylsulfanylphenyl)triazole-4-carboxylic acid Traditional Name: 1-[2-(methylthio)phenyl]triazole-4-carboxylic acid Formula: C10H9N3O2S MolecularWeight: 235.26236

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1N2C=C(N=N2)C(=O)O

Isomeric SMILES

CSC1=CC=CC=C1N2C=C(N=N2)C(=O)O

InChI

InChI=1S/C10H9N3O2S/c1-16-9-5-3-2-4-8(9)13-6-7(10(14)15)11-12-13/h2-6H,1H3,(H,14,15)