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Crystal Structure of a Novel 1,2,4- Triazolo[4,3-a]Pyridine Compound with Antifungal Activity

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Abstract

The title compound 8-chloro-3-((4-cyanobenzyl)thio)-[1,2,4]triazolo[4,3-a]pyridine is prepared from 1- cyano-4-(chloromethyl)benzene and 8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3(2H)-thione in the presence of NaOH, and its structure is determined by the X-ray diffraction analysis. The crystals are monoclinic, space group P2(1)/n, with a = 14.018(8) Å, b = 4.096(2) Å, c = 22.974(12) Å, β = 99.759(9)°, V = 1300.1(12) Å3, and Z = 4, the final R = 0.0343 and wR = 0.0788 for 2505 observed reflections with I > 2σ(I). The preliminary biological test shows that the title compound has activities against Stemphylium lycopersici (Enjoji) Yamamoto, Fusarium oxysporum. sp. cucumebrium, and Botrytis cinerea with inhibitory to be 51.19%, 62.02%, 15.56% respectively.

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Correspondence to X.-H. Liu.

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Original Russian Text © 2018 Q. Wang, Z.-W. Zhai, Z.-H. Sun, M.-Y. Yang, L. Han, X.-H. Liu, C.-X. Tan, J.-Q. Weng.

The text was submitted by the authors in English. Zhurnal Strukturnoi Khimii, Vol. 59, No. 6, pp. 1525–1529, July-August, 2018.

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Wang, Q., Zhai, ZW., Sun, ZH. et al. Crystal Structure of a Novel 1,2,4- Triazolo[4,3-a]Pyridine Compound with Antifungal Activity. J Struct Chem 59, 1473–1477 (2018). https://doi.org/10.1134/S0022476618060331

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