3-phenyl-1,2,3,4-thiatriazol-3-ium-5-olate

Systemtic Name: 3-phenyl-1,2,3,4-thiatriazol-3-ium-5-olate Openeye Name: 3-phenylthiatriazol-3-ium-5-olate CAS Name: 3-phenyl-5-thiatriazol-3-iumolate IUPAC Name: 3-phenylthiatriazol-3-ium-5-olate Traditional Name: 3-phenylthiatriazol-3-ium-5-olate Formula: C7H5N3OS MolecularWeight: 179.1991

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=NSC(=N2)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=NSC(=N2)[O-]

InChI

InChI=1S/C7H5N3OS/c11-7-8-10(9-12-7)6-4-2-1-3-5-6/h1-5H