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CAS 88683-58-3

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3-[(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)thio]butanenitrile

Description:
3-[(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)thio]butanenitrile, with the CAS number 88683-58-3, is a chemical compound characterized by its unique structural features, including a butanenitrile moiety and a thioether linkage to a substituted isoindole. The presence of the dioxo group suggests potential reactivity, particularly in nucleophilic addition or condensation reactions. This compound may exhibit properties typical of both nitriles and thioethers, such as moderate polarity and potential for hydrogen bonding due to the dioxo functionality. Its isoindole core may contribute to biological activity, making it of interest in medicinal chemistry. The compound's synthesis and reactivity can be influenced by the steric and electronic effects of the substituents, which may also affect its solubility and stability in various solvents. Overall, 3-[(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)thio]butanenitrile represents a complex structure that may have applications in pharmaceuticals or organic synthesis, warranting further investigation into its properties and potential uses.
Formula:C12H10N2O2S
InChI:InChI=1S/C12H10N2O2S/c1-8(6-7-13)17-14-11(15)9-4-2-3-5-10(9)12(14)16/h2-5,8H,6H2,1H3
InChI key:InChIKey=BLDXYQMPXBCOIV-UHFFFAOYSA-N
SMILES:O=C1C=2C(C(=O)N1SC(CC#N)C)=CC=CC2
Synonyms:
  • 3-(1,3-Dioxoisoindol-2-yl)sulfanylbutanenitrile
  • 1H-Isoindole-1,3(2H)-dione, 2-[(2-cyano-1-methylethyl)thio]-
  • Butanenitrile, 3-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)thio]-
  • 3-[(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)thio]butanenitrile
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