sodium 4-phenyl-5-pyridin-3-yl-1,2,4-triazole-3-thiolate

Systemtic Name: sodium 4-phenyl-5-pyridin-3-yl-1,2,4-triazole-3-thiolate Openeye Name: sodium 4-phenyl-5-(3-pyridyl)-1,2,4-triazole-3-thiolate CAS Name: sodium 4-phenyl-5-(3-pyridinyl)-1,2,4-triazole-3-thiolate IUPAC Name: sodium 4-phenyl-5-pyridin-3-yl-1,2,4-triazole-3-thiolate Traditional Name: sodium 4-phenyl-5-(3-pyridyl)-1,2,4-triazole-3-thiolate Formula: C13H9N4NaS MolecularWeight: 276.29213

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N4S.Na/c18-13-16-15-12(10-5-4-8-14-9-10)17(13)11-6-2-1-3-7-11;/h1-9H,(H,16,18);/q;+1/p-1