3-(3-methylsulfanyl-5-oxidanidyl-1,2,4-triazin-6-yl)propanoate

Systemtic Name: 3-(3-methylsulfanyl-5-oxidanidyl-1,2,4-triazin-6-yl)propanoate Openeye Name: 3-(3-methylsulfanyl-5-oxido-1,2,4-triazin-6-yl)propanoate CAS Name: 3-[3-(methylthio)-5-oxido-1,2,4-triazin-6-yl]propanoate IUPAC Name: 3-(3-methylsulfanyl-5-oxido-1,2,4-triazin-6-yl)propanoate Traditional Name: 3-[3-(methylthio)-5-oxido-1,2,4-triazin-6-yl]propionate Formula: C7H7N3O3S-2 MolecularWeight: 213.21378

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(N=N1)CCC(=O)[O-])[O-]

Isomeric SMILES

CSC1=NC(=C(N=N1)CCC(=O)[O-])[O-]

InChI

InChI=1S/C7H9N3O3S/c1-14-7-8-6(13)4(9-10-7)2-3-5(11)12/h2-3H2,1H3,(H,11,12)(H,8,10,13)/p-2