(4-oxidanidylpyrazin-4-ium-2-yl)sulfanylmethyl thiocyanate

Systemtic Name: (4-oxidanidylpyrazin-4-ium-2-yl)sulfanylmethyl thiocyanate Openeye Name: (4-oxidopyrazin-4-ium-2-yl)sulfanylmethyl thiocyanate CAS Name: thiocyanic acid [(4-oxido-2-pyrazin-4-iumyl)thio]methyl ester IUPAC Name: (4-oxidopyrazin-4-ium-2-yl)sulfanylmethyl thiocyanate Traditional Name: thiocyanic acid [(4-oxidopyrazin-4-ium-2-yl)thio]methyl ester Formula: C6H5N3OS2 MolecularWeight: 199.2534

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CC(=N1)SCSC#N)[O-]

Isomeric SMILES

C1=C[N+](=CC(=N1)SCSC#N)[O-]

InChI

InChI=1S/C6H5N3OS2/c7-4-11-5-12-6-3-9(10)2-1-8-6/h1-3H,5H2