1-(3-methylsulfanylphenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-(3-methylsulfanylphenyl)-1,2,3-triazole-4-carboxylate Openeye Name: 1-(3-methylsulfanylphenyl)triazole-4-carboxylate CAS Name: 1-[3-(methylthio)phenyl]-4-triazolecarboxylate IUPAC Name: 1-(3-methylsulfanylphenyl)triazole-4-carboxylate Traditional Name: 1-[3-(methylthio)phenyl]triazole-4-carboxylate Formula: C10H8N3O2S- MolecularWeight: 234.25442

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2C=C(N=N2)C(=O)[O-]

Isomeric SMILES

CSC1=CC=CC(=C1)N2C=C(N=N2)C(=O)[O-]

InChI

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