5-(3-nitrophenyl)-4-phenyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(3-nitrophenyl)-4-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 5-(3-nitrophenyl)-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: 5-(3-nitrophenyl)-4-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-(3-nitrophenyl)-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 5-(3-nitrophenyl)-4-phenyl-1,2,4-triazole-3-thiolate Formula: C14H9N4O2S- MolecularWeight: 297.31186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O2S/c19-18(20)12-8-4-5-10(9-12)13-15-16-14(21)17(13)11-6-2-1-3-7-11/h1-9H,(H,16,21)/p-1