4-(3-methylsulfanyl-1,2,4-triazin-5-yl)-4-oxidanylidene-butanoate

Systemtic Name: 4-(3-methylsulfanyl-1,2,4-triazin-5-yl)-4-oxidanylidene-butanoate Openeye Name: 4-(3-methylsulfanyl-1,2,4-triazin-5-yl)-4-oxo-butanoate CAS Name: 4-[3-(methylthio)-1,2,4-triazin-5-yl]-4-oxobutanoate IUPAC Name: 4-(3-methylsulfanyl-1,2,4-triazin-5-yl)-4-oxobutanoate Traditional Name: 4-keto-4-[3-(methylthio)-1,2,4-triazin-5-yl]butyrate Formula: C8H8N3O3S- MolecularWeight: 226.23242

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CN=N1)C(=O)CCC(=O)[O-]

Isomeric SMILES

CSC1=NC(=CN=N1)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C8H9N3O3S/c1-15-8-10-5(4-9-11-8)6(12)2-3-7(13)14/h4H,2-3H2,1H3,(H,13,14)/p-1