benzotriazol-1-ylsulfanylmethyl thiocyanate

Systemtic Name: benzotriazol-1-ylsulfanylmethyl thiocyanate Openeye Name: benzotriazol-1-ylsulfanylmethyl thiocyanate CAS Name: thiocyanic acid (1-benzotriazolylthio)methyl ester IUPAC Name: benzotriazol-1-ylsulfanylmethyl thiocyanate Traditional Name: thiocyanic acid (benzotriazol-1-ylthio)methyl ester Formula: C8H6N4S2 MolecularWeight: 222.29004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2SCSC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2SCSC#N

InChI

InChI=1S/C8H6N4S2/c9-5-13-6-14-12-8-4-2-1-3-7(8)10-11-12/h1-4H,6H2