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

Systemtic Name: 5-[(5-oxidanidyl-1,2,4-triazin-3-yl)sulfanylmethyl]thiophene-2-carboxylate Openeye Name: 5-[(5-oxido-1,2,4-triazin-3-yl)sulfanylmethyl]thiophene-2-carboxylate CAS Name: 5-[[(5-oxido-1,2,4-triazin-3-yl)thio]methyl]-2-thiophenecarboxylate IUPAC Name: 5-[(5-oxido-1,2,4-triazin-3-yl)sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 5-[[(5-oxido-1,2,4-triazin-3-yl)thio]methyl]-2-thenoate Formula: C9H5N3O3S2-2 MolecularWeight: 267.2843

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)C(=O)[O-])CSC2=NC(=CN=N2)[O-]

Isomeric SMILES

C1=C(SC(=C1)C(=O)[O-])CSC2=NC(=CN=N2)[O-]

InChI

InChI=1S/C9H7N3O3S2/c13-7-3-10-12-9(11-7)16-4-5-1-2-6(17-5)8(14)15/h1-3H,4H2,(H,14,15)(H,11,12,13)/p-2