3-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-oxidanylidene-propanoic acid

Systemtic Name: 3-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-oxidanylidene-propanoic acid Openeye Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-2-oxo-propanoic acid CAS Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-2-oxopropanoic acid IUPAC Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-2-oxopropanoic acid Traditional Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-2-keto-propionic acid Formula: C5H6N4O3S MolecularWeight: 202.19114

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)C(=O)O)SC1=NNC(=N1)N

Isomeric SMILES

C(C(=O)C(=O)O)SC1=NNC(=N1)N

InChI

InChI=1S/C5H6N4O3S/c6-4-7-5(9-8-4)13-1-2(10)3(11)12/h1H2,(H,11,12)(H3,6,7,8,9)