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

Systemtic Name: 4-(3-methylsulfanylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(3-methylsulfanylphenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[3-(methylthio)phenyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-(3-methylsulfanylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-[3-(methylthio)phenyl]-1,2,4-triazole-3-thiolate Formula: C9H8N3S2- MolecularWeight: 222.30992

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2C=NN=C2[S-]

Isomeric SMILES

CSC1=CC=CC(=C1)N2C=NN=C2[S-]

InChI

InChI=1S/C9H9N3S2/c1-14-8-4-2-3-7(5-8)12-6-10-11-9(12)13/h2-6H,1H3,(H,11,13)/p-1