[2-methoxy-5-methyl-3-(thiocyanatomethyl)phenyl]methyl thiocyanate

Systemtic Name: [2-methoxy-5-methyl-3-(thiocyanatomethyl)phenyl]methyl thiocyanate Openeye Name: [2-methoxy-5-methyl-3-(thiocyanatomethyl)phenyl]methyl thiocyanate CAS Name: thiocyanic acid [2-methoxy-5-methyl-3-(thiocyanatomethyl)phenyl]methyl ester IUPAC Name: [2-methoxy-5-methyl-3-(thiocyanatomethyl)phenyl]methyl thiocyanate Traditional Name: thiocyanic acid [2-methoxy-5-methyl-3-(thiocyanatomethyl)benzyl] ester Formula: C12H12N2OS2 MolecularWeight: 264.36648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)CSC#N)OC)CSC#N

Isomeric SMILES

CC1=CC(=C(C(=C1)CSC#N)OC)CSC#N

InChI

InChI=1S/C12H12N2OS2/c1-9-3-10(5-16-7-13)12(15-2)11(4-9)6-17-8-14/h3-4H,5-6H2,1-2H3