2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]ethanoic acid Openeye Name: 2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]acetic acid CAS Name: 2-[[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]amino]acetic acid IUPAC Name: 2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]acetic acid Traditional Name: 2-[[2-(1H-1,2,4-triazol-5-ylthio)acetyl]amino]acetic acid Formula: C6H8N4O3S MolecularWeight: 216.21772

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=N1)SCC(=O)NCC(=O)O

Isomeric SMILES

C1=NNC(=N1)SCC(=O)NCC(=O)O

InChI

InChI=1S/C6H8N4O3S/c11-4(7-1-5(12)13)2-14-6-8-3-9-10-6/h3H,1-2H2,(H,7,11)(H,12,13)(H,8,9,10)