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

Systemtic Name: 4-methyl-5-[6-oxidanylidene-1-(phenylmethyl)pyridin-3-yl]-1,2,4-triazole-3-thiolate Openeye Name: 5-(1-benzyl-6-oxo-3-pyridyl)-4-methyl-1,2,4-triazole-3-thiolate CAS Name: 4-methyl-5-[6-oxo-1-(phenylmethyl)-3-pyridinyl]-1,2,4-triazole-3-thiolate IUPAC Name: 5-(1-benzyl-6-oxopyridin-3-yl)-4-methyl-1,2,4-triazole-3-thiolate Traditional Name: 5-(1-benzyl-6-keto-3-pyridyl)-4-methyl-1,2,4-triazole-3-thiolate Formula: C15H13N4OS- MolecularWeight: 297.35492

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1[S-])C2=CN(C(=O)C=C2)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=NN=C1[S-])C2=CN(C(=O)C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C15H14N4OS/c1-18-14(16-17-15(18)21)12-7-8-13(20)19(10-12)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3,(H,17,21)/p-1