[4-cyano-3-(thiocyanatomethylsulfanyl)-1,2-thiazol-5-yl]sulfanylmethyl thiocyanate

Systemtic Name: [4-cyano-3-(thiocyanatomethylsulfanyl)-1,2-thiazol-5-yl]sulfanylmethyl thiocyanate Openeye Name: [4-cyano-3-(thiocyanatomethylsulfanyl)isothiazol-5-yl]sulfanylmethyl thiocyanate CAS Name: thiocyanic acid [[4-cyano-3-(thiocyanatomethylthio)-5-isothiazolyl]thio]methyl ester IUPAC Name: [4-cyano-3-(thiocyanatomethylsulfanyl)-1,2-thiazol-5-yl]sulfanylmethyl thiocyanate Traditional Name: thiocyanic acid [[4-cyano-3-(thiocyanatomethylthio)isothiazol-5-yl]thio]methyl ester Formula: C8H4N4S5 MolecularWeight: 316.46916

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Descriptors Computed from Structure

Canonical SMILES:

C(SC#N)SC1=C(C(=NS1)SCSC#N)C#N

Isomeric SMILES

C(SC#N)SC1=C(C(=NS1)SCSC#N)C#N

InChI

InChI=1S/C8H4N4S5/c9-1-6-7(15-4-13-2-10)12-17-8(6)16-5-14-3-11/h4-5H2