3H-benzimidazol-5-yl thiocyanate

Systemtic Name: 3H-benzimidazol-5-yl thiocyanate Openeye Name: 3H-benzimidazol-5-yl thiocyanate CAS Name: thiocyanic acid 3H-benzimidazol-5-yl ester IUPAC Name: 3H-benzimidazol-5-yl thiocyanate Traditional Name: thiocyanic acid 3H-benzimidazol-5-yl ester Formula: C8H5N3S MolecularWeight: 175.2104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1SC#N)NC=N2

Isomeric SMILES

C1=CC2=C(C=C1SC#N)NC=N2

InChI

InChI=1S/C8H5N3S/c9-4-12-6-1-2-7-8(3-6)11-5-10-7/h1-3,5H,(H,10,11)