(2S)-3-methyl-2-[(3-oxidanidyl-5-oxidanylidene-2H-1,2,4-triazin-6-yl)sulfanyl]butanoate

Systemtic Name: (2S)-3-methyl-2-[(3-oxidanidyl-5-oxidanylidene-2H-1,2,4-triazin-6-yl)sulfanyl]butanoate Openeye Name: (2S)-3-methyl-2-[(3-oxido-5-oxo-2H-1,2,4-triazin-6-yl)sulfanyl]butanoate CAS Name: (2S)-3-methyl-2-[(3-oxido-5-oxo-2H-1,2,4-triazin-6-yl)thio]butanoate IUPAC Name: (2S)-3-methyl-2-[(3-oxido-5-oxo-2H-1,2,4-triazin-6-yl)sulfanyl]butanoate Traditional Name: (2S)-2-[(5-keto-3-oxido-2H-1,2,4-triazin-6-yl)thio]-3-methyl-butyrate Formula: C8H9N3O4S-2 MolecularWeight: 243.23976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])SC1=NNC(=NC1=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])SC1=NNC(=NC1=O)[O-]

InChI

InChI=1S/C8H11N3O4S/c1-3(2)4(7(13)14)16-6-5(12)9-8(15)11-10-6/h3-4H,1-2H3,(H,13,14)(H2,9,11,12,15)/p-2/t4-/m0/s1