4-(3-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-olate

Systemtic Name: 4-(3-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-olate Openeye Name: 4-(3-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-3-olate CAS Name: 4-(3-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-olate IUPAC Name: 4-(3-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-olate Traditional Name: 4-(3-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-3-olate Formula: C8H5ClN3OS- MolecularWeight: 226.6628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H6ClN3OS/c9-5-2-1-3-6(4-5)12-7(13)10-11-8(12)14/h1-4H,(H,10,13)(H,11,14)/p-1