Design, Synthesis, Fungicidal Activity and Docking Study of Acyl Thiourea Derivatives Containing Pyrazole Moiety

被引：26
作者：
Sun, Nabo [1 ]
Shen, Zhonghua [2 ]
Zhai, Zhiwen [2 ]
Han, Liang [2 ]
Weng, Jianquan [2 ]
Tan, Chengxia [2 ]
Liu, Xinghai [2 ]
机构：
[1] Zhejiang Shuren Univ, Coll Biol & Environm Engn, Hangzhou 310015, Zhejiang, Peoples R China
[2] Zhejiang Univ Technol, Coll Chem Engn, Hangzhou 310014, Zhejiang, Peoples R China
来源：
CHINESE JOURNAL OF ORGANIC CHEMISTRY | 2017年 / 37卷 / 10期
基金：
中国国家自然科学基金;
关键词：
pyrazole; acyl thiourea; synthesis; fungicidal activity; docking; ANTIFUNGAL ACTIVITY; NEMATOCIDAL ACTIVITY; BIOLOGICAL-ACTIVITIES; UREA DERIVATIVES;
D O I：
10.6023/cjoc201704032
中图分类号：
O62 [有机化学];
学科分类号：
070303 ; 081704 ;
摘要：
A series of novel acyl thiourea derivatives containing pyrazole moiety were designed and synthesized from ethyl acetoacetate, triethyl orthoformate, methylhydrazine by multi-step reactions. Their structures were characterized by H-1 NMR, C-13 NMR and HRMS. The target compounds were evaluated for their fungicidal activity. The results indicated that some of the title compounds displayed certain fungicidal activities against Botryospuaeria berengeriana. The docking results indicated that the hydrogen bond and pi(sigma)-pi interaction formed between N-((2,6-diethylphenyl)carbamothioyl)-1,3-dimethyl-1H-pyrazole-4-carboxamide (6k) and succinodehydrogenase.
引用
收藏
页码：2705 / 2710
页数：6
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