2-[3-(carboxymethylsulfanyl)-5-oxidanylidene-2H-1,2,4-triazin-6-yl]ethanoic acid

Systemtic Name: 2-[3-(carboxymethylsulfanyl)-5-oxidanylidene-2H-1,2,4-triazin-6-yl]ethanoic acid Openeye Name: 2-[3-(carboxymethylsulfanyl)-5-oxo-2H-1,2,4-triazin-6-yl]acetic acid CAS Name: 2-[3-(carboxymethylthio)-5-oxo-2H-1,2,4-triazin-6-yl]acetic acid IUPAC Name: 2-[3-(carboxymethylsulfanyl)-5-oxo-2H-1,2,4-triazin-6-yl]acetic acid Traditional Name: 2-[3-(carboxymethylthio)-5-keto-2H-1,2,4-triazin-6-yl]acetic acid Formula: C7H7N3O5S MolecularWeight: 245.21258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C1=NNC(=NC1=O)SCC(=O)O)C(=O)O

Isomeric SMILES

C(C1=NNC(=NC1=O)SCC(=O)O)C(=O)O

InChI

InChI=1S/C7H7N3O5S/c11-4(12)1-3-6(15)8-7(10-9-3)16-2-5(13)14/h1-2H2,(H,11,12)(H,13,14)(H,8,10,15)