3-(4-acetamido-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanoic acid

Systemtic Name: 3-(4-acetamido-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanoic acid Openeye Name: 3-(4-acetamido-5-oxo-3-thioxo-2H-1,2,4-triazin-6-yl)propanoic acid CAS Name: 3-(4-acetamido-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanoic acid IUPAC Name: 3-(4-acetamido-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanoic acid Traditional Name: 3-(4-acetamido-5-keto-3-thioxo-2H-1,2,4-triazin-6-yl)propionic acid Formula: C8H10N4O4S MolecularWeight: 258.2544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NN1C(=O)C(=NNC1=S)CCC(=O)O

Isomeric SMILES

CC(=O)NN1C(=O)C(=NNC1=S)CCC(=O)O

InChI

InChI=1S/C8H10N4O4S/c1-4(13)11-12-7(16)5(2-3-6(14)15)9-10-8(12)17/h2-3H2,1H3,(H,10,17)(H,11,13)(H,14,15)