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CAS 4845-58-3

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6-Nitro-2(3H)-benzothiazolethione

Description:
6-Nitro-2(3H)-benzothiazolethione, with the CAS number 4845-58-3, is a heterocyclic compound characterized by the presence of both a nitro group and a thiazole ring. This compound features a benzothiazole structure, which is a fused ring system that includes a benzene ring and a thiazole moiety. The nitro group, which is an electron-withdrawing substituent, can influence the compound's reactivity and properties. Typically, compounds like this exhibit biological activity, making them of interest in pharmaceutical and agrochemical research. The presence of the thione functional group (–C=S) suggests potential applications in coordination chemistry and as a ligand in metal complexes. Additionally, the compound may exhibit specific solubility characteristics, stability under various conditions, and potential toxicity, which are important for its handling and application in research. Overall, 6-Nitro-2(3H)-benzothiazolethione is a compound of interest due to its unique structural features and potential applications in various fields of chemistry.
Formula:C7H4N2O2S2
InChI:InChI=1S/C7H4N2O2S2/c10-9(11)4-1-2-5-6(3-4)13-7(12)8-5/h1-3H,(H,8,12)
InChI key:InChIKey=QPOZGXKWWKLJDK-UHFFFAOYSA-N
SMILES:N(=O)(=O)C=1C=C2C(=CC1)NC(=S)S2
Synonyms:
  • 2(3H)-Benzothiazolethione, 6-nitro-
  • 2-Benzothiazolethio
  • 2-Benzothiazolethiol, 6-nitro-
  • 2-Benzothiazolinethione, 6-nitro-
  • 5-nitro-1,3-dihydro-2H-benzimidazole-2-thione
  • 6-Nitro-2(3H)-benzothiazolethione
  • 6-Nitro-2-benzothiazolinethione
  • 6-Nitro-2-mercaptobenzo[d]thiazole
  • 6-Nitro-2-mercaptobenzothiazole
  • 6-Nitrobenzothiazole-2-thiol
  • See more synonyms
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