4-azanyl-5-[6-oxidanylidene-1-(phenylmethyl)pyridin-3-yl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-azanyl-5-[6-oxidanylidene-1-(phenylmethyl)pyridin-3-yl]-1,2,4-triazole-3-thiolate Openeye Name: 4-amino-5-(1-benzyl-6-oxo-3-pyridyl)-1,2,4-triazole-3-thiolate CAS Name: 4-amino-5-[6-oxo-1-(phenylmethyl)-3-pyridinyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-amino-5-(1-benzyl-6-oxopyridin-3-yl)-1,2,4-triazole-3-thiolate Traditional Name: 4-amino-5-(1-benzyl-6-keto-3-pyridyl)-1,2,4-triazole-3-thiolate Formula: C14H12N5OS- MolecularWeight: 298.34298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=CC2=O)C3=NN=C(N3N)[S-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=CC2=O)C3=NN=C(N3N)[S-]

InChI

InChI=1S/C14H13N5OS/c15-19-13(16-17-14(19)21)11-6-7-12(20)18(9-11)8-10-4-2-1-3-5-10/h1-7,9H,8,15H2,(H,17,21)/p-1