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

Systemtic Name: 3-[(3-oxidanylidene-2H-1,2,4-triazin-5-yl)sulfanyl]propanoic acid Openeye Name: 3-[(3-oxo-2H-1,2,4-triazin-5-yl)sulfanyl]propanoic acid CAS Name: 3-[(3-oxo-2H-1,2,4-triazin-5-yl)thio]propanoic acid IUPAC Name: 3-[(3-oxo-2H-1,2,4-triazin-5-yl)sulfanyl]propanoic acid Traditional Name: 3-[(3-keto-2H-1,2,4-triazin-5-yl)thio]propionic acid Formula: C6H7N3O3S MolecularWeight: 201.20308

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=O)N=C1SCCC(=O)O

Isomeric SMILES

C1=NNC(=O)N=C1SCCC(=O)O

InChI

InChI=1S/C6H7N3O3S/c10-5(11)1-2-13-4-3-7-9-6(12)8-4/h3H,1-2H2,(H,10,11)(H,8,9,12)