Cas no 2229464-32-6 (5-cyanothiophene-2-carbothioamide)

5-Cyanothiophene-2-carbothioamide is a heterocyclic compound featuring both cyano and carbothioamide functional groups on a thiophene backbone. This structure imparts reactivity suitable for applications in pharmaceutical and agrochemical synthesis, particularly as a versatile intermediate in the preparation of thiazole and other sulfur-containing heterocycles. The presence of the electron-withdrawing cyano group enhances its utility in nucleophilic substitution and cyclization reactions. Its thioamide moiety allows for further functionalization, making it valuable in medicinal chemistry for the development of bioactive molecules. The compound’s stability and well-defined reactivity profile ensure consistent performance in synthetic workflows.
5-cyanothiophene-2-carbothioamide structure
2229464-32-6 structure
Product Name:5-cyanothiophene-2-carbothioamide
CAS No:2229464-32-6
MF:C6H4N2S2
MW:168.239357948303
CID:5887152
PubChem ID:165705358
Update Time:2025-10-15

5-cyanothiophene-2-carbothioamide Chemical and Physical Properties

Names and Identifiers

    • 5-cyanothiophene-2-carbothioamide
    • EN300-1748645
    • 2229464-32-6
    • Inchi: 1S/C6H4N2S2/c7-3-4-1-2-5(10-4)6(8)9/h1-2H,(H2,8,9)
    • InChI Key: NTBOIDVABAHJGA-UHFFFAOYSA-N
    • SMILES: S1C(C#N)=CC=C1C(N)=S

Computed Properties

  • Exact Mass: 167.98159048g/mol
  • Monoisotopic Mass: 167.98159048g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 193
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.5
  • Topological Polar Surface Area: 110?2

5-cyanothiophene-2-carbothioamide Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-1748645-0.05g
5-cyanothiophene-2-carbothioamide
2229464-32-6
0.05g
$1080.0 2023-09-20
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EN300-1748645-0.1g
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$1131.0 2023-09-20
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EN300-1748645-0.25g
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$1183.0 2023-09-20
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EN300-1748645-0.5g
5-cyanothiophene-2-carbothioamide
2229464-32-6
0.5g
$1234.0 2023-09-20
Enamine
EN300-1748645-1.0g
5-cyanothiophene-2-carbothioamide
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$1286.0 2023-06-03
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EN300-1748645-2.5g
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$2520.0 2023-09-20
Enamine
EN300-1748645-5.0g
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$3728.0 2023-06-03
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EN300-1748645-10.0g
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$5528.0 2023-06-03
Enamine
EN300-1748645-1g
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$1286.0 2023-09-20
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