O-phenyl 2-cyanopropan-2-ylsulfanylmethanethioate

Systemtic Name: O-phenyl 2-cyanopropan-2-ylsulfanylmethanethioate Openeye Name: O-phenyl (1-cyano-1-methyl-ethyl)sulfanylmethanethioate CAS Name: (2-cyanopropan-2-ylthio)methanethioic acid O-phenyl ester IUPAC Name: O-phenyl 2-cyanopropan-2-ylsulfanylmethanethioate Traditional Name: [(1-cyano-1-methyl-ethyl)thio]methanethioic acid O-phenyl ester Formula: C11H11NOS2 MolecularWeight: 237.34114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)SC(=S)OC1=CC=CC=C1

Isomeric SMILES

CC(C)(C#N)SC(=S)OC1=CC=CC=C1

InChI

InChI=1S/C11H11NOS2/c1-11(2,8-12)15-10(14)13-9-6-4-3-5-7-9/h3-7H,1-2H3