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CAS 129119-80-8

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2,4-Dihydro-4-(phenylmethyl)-5-(3-pyridinyl)-3H-1,2,4-triazole-3-thione

Description:
2,4-Dihydro-4-(phenylmethyl)-5-(3-pyridinyl)-3H-1,2,4-triazole-3-thione, with CAS number 129119-80-8, is a chemical compound characterized by its triazole ring structure, which is a five-membered heterocyclic compound containing three nitrogen atoms. This substance features a thione functional group, indicating the presence of a sulfur atom double-bonded to a carbon atom, contributing to its reactivity and potential biological activity. The phenylmethyl and pyridinyl substituents enhance its lipophilicity and may influence its interaction with biological targets. Compounds of this nature are often investigated for their pharmacological properties, including antifungal, antibacterial, or anticancer activities. The presence of multiple heteroatoms in the structure can also affect solubility and stability in various solvents. Overall, the unique combination of functional groups and structural features makes this compound of interest in medicinal chemistry and drug development.
Formula:C14H12N4S
InChI:InChI=1S/C14H12N4S/c19-14-17-16-13(12-7-4-8-15-9-12)18(14)10-11-5-2-1-3-6-11/h1-9H,10H2,(H,17,19)
InChI key:InChIKey=PXHPPVLWNLIWNR-UHFFFAOYSA-N
SMILES:C(N1C(=NNC1=S)C=2C=CC=NC2)C3=CC=CC=C3
Synonyms:
  • 2,4-Dihydro-4-(phenylmethyl)-5-(3-pyridinyl)-3H-1,2,4-triazole-3-thione
  • 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(phenylmethyl)-5-(3-pyridinyl)-
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