1,4-diphenyl-1,2,4-triazol-4-ium-3-thiolate

Systemtic Name: 1,4-diphenyl-1,2,4-triazol-4-ium-3-thiolate Openeye Name: 1,4-diphenyl-1,2,4-triazol-4-ium-3-thiolate CAS Name: 1,4-diphenyl-1,2,4-triazol-4-ium-3-thiolate IUPAC Name: 1,4-diphenyl-1,2,4-triazol-4-ium-3-thiolate Traditional Name: 1,4-diphenyl-1,2,4-triazol-4-ium-3-thiolate Formula: C14H11N3S MolecularWeight: 253.32224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=[N+](C(=N2)[S-])C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C=[N+](C(=N2)[S-])C3=CC=CC=C3

InChI

InChI=1S/C14H11N3S/c18-14-15-17(13-9-5-2-6-10-13)11-16(14)12-7-3-1-4-8-12/h1-11H