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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

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.

作者信息

Al-Tamimi Abdul-Malek S, Bari Ahmed, Al-Omar Mohamed A, Alrashood Khalid A, El-Emam Ali A

机构信息

Department of Pharmaceutical Chemistry, College of Pharmacy, King Saud University, Riyadh 11451, Saudi Arabia.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Jun 23;66(Pt 7):o1756. doi: 10.1107/S1600536810022695.

DOI:10.1107/S1600536810022695
PMID:21587972
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3006920/
Abstract

The title compound, C(25)H(35)N(5)OS, is a functionalized triazoline-3-thione with substituted piperazine and adamantyl substituents attached at the 2- and 5-positions, respectively, of a triazole spacer with an approximately C-shaped conformation of the mol-ecule. The piperazine ring adopts a chair conformation.

摘要

标题化合物C(25)H(35)N(5)OS是一种功能化的三唑啉-3-硫酮，在具有近似C形分子构象的三唑间隔基的2位和5位分别连接有取代的哌嗪和金刚烷基取代基。哌嗪环呈椅式构象。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/de27/3006920/7f04423f3074/e-66-o1756-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/de27/3006920/7f04423f3074/e-66-o1756-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/de27/3006920/7f04423f3074/e-66-o1756-fig1.jpg

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本文引用的文献

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2
Synthesis, antimicrobial, and anti-inflammatory activities of novel 5-(1-adamantyl)-4-arylideneamino-3-mercapto-1,2,4-triazoles and related derivatives.新型 5-(1-金刚烷基)-4-芳亚甲基氨基-3-巯基-1,2,4-三唑及其相关衍生物的合成、抗菌和抗炎活性。
Molecules. 2010 Apr 9;15(4):2526-50. doi: 10.3390/molecules15042526.
3
A short history of SHELX.
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3-(Adamantan-1-yl)-4-ethyl-1-[(4-phenyl-piperazin-1-yl)meth-yl]-1H-1,2,4-triazole-5(4H)-thione.3-（金刚烷-1-基）-4-乙基-1- [（4-苯基-哌嗪-1-基）甲基] -1H-1,2,4-三唑-5（4H）-硫酮
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5
5-(Adamantan-1-yl)-3-[(4-benzyl-piperazin-1-yl)meth-yl]-1,3,4-oxadiazole-2(3H)-thione.5-（金刚烷-1-基）-3-[(4-苄基-哌嗪-1-基)甲基]-1,3,4-恶二唑-2(3H)-硫酮
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SHELX简史。
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Eur J Med Chem. 2007 Feb;42(2):235-42. doi: 10.1016/j.ejmech.2006.10.003. Epub 2006 Nov 28.
6
Synthesis, antimicrobial, and anti-inflammatory activities of novel 2-[3-(1-adamantyl)-4-substituted-5-thioxo-1,2,4-triazolin-1-yl] acetic acids, 2-[3-(1-adamantyl)-4-substituted-5-thioxo-1,2,4-triazolin-1-yl]propionic acids and related derivatives.新型2-[3-(1-金刚烷基)-4-取代-5-硫代-1,2,4-三唑啉-1-基]乙酸、2-[3-(1-金刚烷基)-4-取代-5-硫代-1,2,4-三唑啉-1-基]丙酸及相关衍生物的合成、抗菌和抗炎活性
Arzneimittelforschung. 2006;56(1):40-7. doi: 10.1055/s-0031-1296699.
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Synthesis, antimicrobial, and anti-HIV-1 activity of certain 5-(1-adamantyl)-2-substituted thio-1,3,4-oxadiazoles and 5-(1-adamantyl)-3-substituted aminomethyl-1,3,4-oxadiazoline-2-thiones.某些5-(1-金刚烷基)-2-取代硫代-1,3,4-恶二唑和5-(1-金刚烷基)-3-取代氨甲基-1,3,4-恶二唑啉-2-硫酮的合成、抗菌及抗HIV-1活性
Bioorg Med Chem. 2004 Oct 1;12(19):5107-13. doi: 10.1016/j.bmc.2004.07.033.
8
Comparative toxicity of amantadine hydrochloride and rimantadine hydrochloride in healthy adults.盐酸金刚烷胺与盐酸金刚乙胺对健康成年人的毒性比较
Antimicrob Agents Chemother. 1981 Feb;19(2):226-33. doi: 10.1128/AAC.19.2.226.
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The toxicologic and pharmacologic properties of amantadine hydrochloride.盐酸金刚烷胺的毒理学和药理学特性。
Toxicol Appl Pharmacol. 1969 Nov;15(3):642-65. doi: 10.1016/0041-008x(69)90066-0.