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CAS 20069-34-5

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3-Phenyl-1,2,4-thiadiazole-5(2H)-thione

Description:
3-Phenyl-1,2,4-thiadiazole-5(2H)-thione is a heterocyclic compound characterized by a thiadiazole ring, which contains both sulfur and nitrogen atoms. This compound features a phenyl group attached to the thiadiazole, contributing to its aromatic properties. The presence of the thione functional group (–C=S) indicates that it has a sulfur atom double-bonded to a carbon atom, which can influence its reactivity and stability. Typically, compounds of this nature exhibit interesting biological activities, including potential antimicrobial and antifungal properties, making them of interest in medicinal chemistry. The molecular structure allows for various interactions, including hydrogen bonding and π-π stacking, which can affect solubility and reactivity. Additionally, the compound may exhibit fluorescence or other optical properties, depending on its environment. Its applications can extend to materials science, particularly in the development of organic semiconductors or sensors. Overall, 3-Phenyl-1,2,4-thiadiazole-5(2H)-thione is a versatile compound with potential utility in various chemical and pharmaceutical applications.
Formula:C8H6N2S2
InChI:InChI=1S/C8H6N2S2/c11-8-9-7(10-12-8)6-4-2-1-3-5-6/h1-5H,(H,9,10,11)
InChI key:InChIKey=NAKQCFRTJSBUPT-UHFFFAOYSA-N
SMILES:S=C1NC(=NS1)C2=CC=CC=C2
Synonyms:
  • 3-Phenyl-1,2,4-thiadiazole-5-thiol
  • 1,2,4-Thiadiazole-5-thiol, 3-phenyl-
  • 3-Phenyl-1,2,4-thiadiazole-5(2H)-thione
  • 1,2,4-Thiadiazole-5(2H)-thione, 3-phenyl-
  • 1,2,4-Thiadiazoline-5-thione, 3-phenyl-
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