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3-[4-氨基-3-(4-甲基苯基)-5-硫亚基-4,5-二氢-1H-1,2,4-三唑-1-基]-3-(2-氯苯基)-1-苯基丙-1-酮

3-[4-Amino-3-(4-methyl-phen-yl)-5-sulfanyl-idene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-3-(2-chloro-phen-yl)-1-phenyl-propan-1-one.

作者信息

Wang Wei, Liu Qing-Lei, Jia Xiao-Yu, Zhang Jing-Jing, Gao Yan

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Jul 1;67(Pt 7):o1793. doi: 10.1107/S1600536811023993. Epub 2011 Jun 25.

DOI:10.1107/S1600536811023993
PMID:21837166
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3151860/
Abstract

In the title mol-ecule, C(24)H(21)ClN(4)OS, the 1,2,4-triazole ring forms dihedral angles of 37.2 (2), 71.9 (2) and 84.9 (2) ° with the three benzene rings. In the crystal, weak inter-molecular N-H⋯S hydrogen bonds link the mol-ecules into centrosymmetric dimers.

摘要

在标题分子C₂₄H₂₁ClN₄OS中，1,2,4 - 三唑环与三个苯环形成的二面角分别为37.2（2）°、71.9（2）°和84.9（2）°。在晶体中，分子间微弱的N - H⋯S氢键将分子连接成中心对称的二聚体。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1a86/3151860/ff6f6f1293de/e-67-o1793-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1a86/3151860/ff6f6f1293de/e-67-o1793-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1a86/3151860/ff6f6f1293de/e-67-o1793-fig1.jpg

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本文引用的文献

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3-(1-Adamant-yl)-1-{[4-(2-meth-oxy-phen-yl)piperazin-1-yl]meth-yl}-4-methyl-1H-1,2,4-triazole-5(4H)-thione.3-（1-金刚烷基）-1-{[4-（2-甲氧基苯基）哌嗪-1-基]甲基}-4-甲基-1H-1,2,4-三唑-5（4H）-硫酮
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