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CAS 175202-50-3

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6,6-DIMETHYL-3-(METHYLTHIO)-4-OXO-4,5,6,7-TETRAHYDROBENZO[C]THIOPHENE-1-CARBONITRILE

Description:
6,6-Dimethyl-3-(methylthio)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carbonitrile is a heterocyclic compound characterized by its complex structure, which includes a benzo[c]thiophene core fused with a tetrahydro ring. The presence of a carbonitrile group indicates that it contains a cyano functional group, which can contribute to its reactivity and potential applications in organic synthesis. The dimethyl and methylthio substituents enhance its chemical diversity, potentially influencing its solubility, polarity, and biological activity. This compound may exhibit interesting pharmacological properties, making it a candidate for further research in medicinal chemistry. Its unique structural features suggest potential applications in the development of agrochemicals or pharmaceuticals. As with many heterocycles, the stability and reactivity of this compound can be influenced by the electronic effects of the substituents and the overall molecular conformation. Safety and handling precautions should be observed, as with any chemical substance, particularly those with potential biological activity.
Formula:C12H13NOS2
InChI:InChI=1/C12H13NOS2/c1-12(2)4-7-9(6-13)16-11(15-3)10(7)8(14)5-12/h4-5H2,1-3H3
SMILES:CC1(C)Cc2c(C#N)sc(c2C(=O)C1)SC
Synonyms:
  • Buttpark 94\04-53
  • 1-Cyano-6,6-Dimethyl-3-(Methylthio)-4,5,6,7-Tetrahydrobenzo(C)Thiophen-4-One
  • 6,6-Dimethyl-3-(Methylsulfanyl)-4-Oxo-4,5,6,7-Tetrahydro-2-Benzothiophene-1-Carbonitrile
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