3-(3-methylsulfanyl-6,7-dihydro-2-benzothiophen-1-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(3-methylsulfanyl-6,7-dihydro-2-benzothiophen-1-yl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(3-methylsulfanyl-6,7-dihydro-2-benzothiophen-1-yl)-3-oxo-propanenitrile CAS Name: 3-[3-(methylthio)-6,7-dihydro-2-benzothiophen-1-yl]-3-oxopropanenitrile IUPAC Name: 3-(3-methylsulfanyl-6,7-dihydro-2-benzothiophen-1-yl)-3-oxopropanenitrile Traditional Name: 3-keto-3-[3-(methylthio)-6,7-dihydroisobenzothiophen-1-yl]propionitrile Formula: C12H11NOS2 MolecularWeight: 249.35184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C2C=CCCC2=C(S1)C(=O)CC#N

Isomeric SMILES

CSC1=C2C=CCCC2=C(S1)C(=O)CC#N

InChI

InChI=1S/C12H11NOS2/c1-15-12-9-5-3-2-4-8(9)11(16-12)10(14)6-7-13/h3,5H,2,4,6H2,1H3