5-[(6-methyl-5-oxidanidyl-1,2,4-triazin-3-yl)sulfanylmethyl]thiophene-2-carboxylate

Systemtic Name: 5-[(6-methyl-5-oxidanidyl-1,2,4-triazin-3-yl)sulfanylmethyl]thiophene-2-carboxylate Openeye Name: 5-[(6-methyl-5-oxido-1,2,4-triazin-3-yl)sulfanylmethyl]thiophene-2-carboxylate CAS Name: 5-[[(6-methyl-5-oxido-1,2,4-triazin-3-yl)thio]methyl]-2-thiophenecarboxylate IUPAC Name: 5-[(6-methyl-5-oxido-1,2,4-triazin-3-yl)sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 5-[[(6-methyl-5-oxido-1,2,4-triazin-3-yl)thio]methyl]-2-thenoate Formula: C10H7N3O3S2-2 MolecularWeight: 281.31088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)SCC2=CC=C(S2)C(=O)[O-])[O-]

Isomeric SMILES

CC1=C(N=C(N=N1)SCC2=CC=C(S2)C(=O)[O-])[O-]

InChI

InChI=1S/C10H9N3O3S2/c1-5-8(14)11-10(13-12-5)17-4-6-2-3-7(18-6)9(15)16/h2-3H,4H2,1H3,(H,15,16)(H,11,13,14)/p-2