(2-cyano-4-methoxy-1,3-benzothiazol-6-yl) thiocyanate

Systemtic Name: (2-cyano-4-methoxy-1,3-benzothiazol-6-yl) thiocyanate Openeye Name: (2-cyano-4-methoxy-1,3-benzothiazol-6-yl) thiocyanate CAS Name: thiocyanic acid (2-cyano-4-methoxy-1,3-benzothiazol-6-yl) ester IUPAC Name: (2-cyano-4-methoxy-1,3-benzothiazol-6-yl) thiocyanate Traditional Name: thiocyanic acid (2-cyano-4-methoxy-1,3-benzothiazol-6-yl) ester Formula: C10H5N3OS2 MolecularWeight: 247.2962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1N=C(S2)C#N)SC#N

Isomeric SMILES

COC1=CC(=CC2=C1N=C(S2)C#N)SC#N

InChI

InChI=1S/C10H5N3OS2/c1-14-7-2-6(15-5-12)3-8-10(7)13-9(4-11)16-8/h2-3H,1H3