6,6-Dimethyl-3-(methylthio)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carbonitrile

Catalog Number	ACM175202503-1
CAS Number	175202-50-3
Structure
Synonyms	4,5,6,7-Tetrahydro-6,6-dimethyl-3-(methylthio)-4-oxobenzo[c]thiophene-1-carbonitrile
IUPAC Name	6,6-dimethyl-3-methylsulfanyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carbonitrile
Molecular Weight	251.37
Molecular Formula	C12H13NOS2
Canonical SMILES	CC1(CC2=C(SC(=C2C(=O)C1)SC)C#N)C
InChI	InChI=1S/C12H13NOS2/c1-12(2)4-7-9(6-13)16-11(15-3)10(7)8(14)5-12/h4-5H2,1-3H3
InChI Key	REHLIMHCZVPSPB-UHFFFAOYSA-N
Melting Point	172-175 ºC
Purity	97%+