CAS 669737-47-7

4-Ethyl-2,4-dihydro-5-[1-(4-methoxyphenoxy)ethyl]-3H-1,2,4-triazole-3-thione

Description:

4-Ethyl-2,4-dihydro-5-[1-(4-methoxyphenoxy)ethyl]-3H-1,2,4-triazole-3-thione 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, which contributes to its reactivity and potential biological activity. The presence of an ethyl group and a 4-methoxyphenoxyethyl substituent suggests that the compound may exhibit lipophilic properties, enhancing its ability to interact with biological membranes. Its structure indicates potential applications in agricultural chemistry, particularly as a fungicide or herbicide, due to the triazole moiety's known efficacy in inhibiting fungal growth. Additionally, the methoxy group may influence its solubility and bioavailability. Overall, this compound's unique structural features position it as a candidate for further research in both synthetic and medicinal chemistry contexts.

Formula: C₁₃H₁₇N₃O₂S

InChI: InChI=1/C13H17N3O2S/c1-4-16-12(14-15-13(16)19)9(2)18-11-7-5-10(17-3)6-8-11/h5-9H,4H2,1-3H3,(H,15,19)

InChI key: InChIKey=PBZBPPPJRPZJHC-UHFFFAOYSA-N

SMILES: C(OC1=CC=C(OC)C=C1)(C)C=2N(CC)C(=S)NN2

Synonyms:

• 3H-1,2,4-Triazole-3-thione, 4-ethyl-2,4-dihydro-5-[1-(4-methoxyphenoxy)ethyl]-
• 4-Ethyl-2,4-dihydro-5-[1-(4-methoxyphenoxy)ethyl]-3H-1,2,4-triazole-3-thione
• 4H-1,2,4-triazole-3-thiol, 4-ethyl-5-[1-(4-methoxyphenoxy)ethyl]-

4-Ethyl-5-[1-(4-methoxyphenoxy)ethyl]-4H-1,2,4-triazole-3-thiol

CAS: 669737-47-7

Formula: C₁₃H₁₇N₃O₂S

Molecular weight: 279.3580

Ref: IN-DA00FD1C

4-ethyl-5-[1-(4-methoxyphenoxy)ethyl]-4H-1,2,4-triazole-3-thiol

CAS: 669737-47-7

Formula: C₁₃H₁₇N₃O₂S

Purity: 95.0%

Molecular weight: 279.36

Ref: 10-F307817