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

Systemtic Name: sodium 5-(4-nitrophenyl)-4-phenyl-1,2,4-triazole-3-thiolate Openeye Name: sodium 5-(4-nitrophenyl)-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: sodium 5-(4-nitrophenyl)-4-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: sodium 5-(4-nitrophenyl)-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: sodium 5-(4-nitrophenyl)-4-phenyl-1,2,4-triazole-3-thiolate Formula: C14H9N4NaO2S MolecularWeight: 320.30163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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