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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC(=O)C=NN1

Isomeric SMILES

C[C@@H](C(=O)O)SC1=NC(=O)C=NN1

InChI

InChI=1S/C6H7N3O3S/c1-3(5(11)12)13-6-8-4(10)2-7-9-6/h2-3H,1H3,(H,11,12)(H,8,9,10)/t3-/m0/s1