5-oxidanylidene-6-(phenylmethylsulfanyl)-2H-1,2,4-triazin-3-olate

Systemtic Name: 5-oxidanylidene-6-(phenylmethylsulfanyl)-2H-1,2,4-triazin-3-olate Openeye Name: 6-benzylsulfanyl-5-oxo-2H-1,2,4-triazin-3-olate CAS Name: 5-oxo-6-(phenylmethylthio)-2H-1,2,4-triazin-3-olate IUPAC Name: 6-benzylsulfanyl-5-oxo-2H-1,2,4-triazin-3-olate Traditional Name: 6-(benzylthio)-5-keto-2H-1,2,4-triazin-3-olate Formula: C10H8N3O2S- MolecularWeight: 234.25442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NNC(=NC2=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NNC(=NC2=O)[O-]

InChI

InChI=1S/C10H9N3O2S/c14-8-9(12-13-10(15)11-8)16-6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,13,14,15)/p-1