(3-methoxy-5-oxidanylidene-2H-1,2,5-thiadiazol-5-ium-4-yl)methyl thiocyanate

Systemtic Name: (3-methoxy-5-oxidanylidene-2H-1,2,5-thiadiazol-5-ium-4-yl)methyl thiocyanate Openeye Name: (3-methoxy-5-oxo-2H-1,2,5-thiadiazol-5-ium-4-yl)methyl thiocyanate CAS Name: thiocyanic acid (3-methoxy-5-oxo-2H-1,2,5-thiadiazol-5-ium-4-yl)methyl ester IUPAC Name: (3-methoxy-5-oxo-2H-1,2,5-thiadiazol-5-ium-4-yl)methyl thiocyanate Traditional Name: thiocyanic acid (5-keto-3-methoxy-2H-1,2,5-thiadiazol-5-ium-4-yl)methyl ester Formula: C5H6N3O2S2+ MolecularWeight: 204.25004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C([N+](=O)SN1)CSC#N

Isomeric SMILES

COC1=C([N+](=O)SN1)CSC#N

InChI

InChI=1S/C5H6N3O2S2/c1-10-5-4(2-11-3-6)8(9)12-7-5/h7H,2H2,1H3/q+1