• 文献检索
  • 文档翻译
  • 深度研究
  • 学术资讯
  • Suppr Zotero 插件Zotero 插件
  • 邀请有礼
  • 套餐&价格
  • 历史记录
应用&插件
Suppr Zotero 插件Zotero 插件浏览器插件Mac 客户端Windows 客户端微信小程序
定价
高级版会员购买积分包购买API积分包
服务
文献检索文档翻译深度研究API 文档MCP 服务
关于我们
关于 Suppr公司介绍联系我们用户协议隐私条款
关注我们

Suppr 超能文献

核心技术专利:CN118964589B侵权必究
粤ICP备2023148730 号-1Suppr @ 2026

文献检索

告别复杂PubMed语法,用中文像聊天一样搜索,搜遍4000万医学文献。AI智能推荐,让科研检索更轻松。

立即免费搜索

文件翻译

保留排版,准确专业,支持PDF/Word/PPT等文件格式,支持 12+语言互译。

免费翻译文档

深度研究

AI帮你快速写综述,25分钟生成高质量综述,智能提取关键信息,辅助科研写作。

立即免费体验

2-苄基-4-羟基-1,1-二氧代-1,2,3,4-四氢-1λ,2-苯并噻嗪-3-羧酸甲酯

Methyl 2-benzyl-4-hy-droxy-1,1-dioxo-1,2,3,4-tetra-hydro-1λ,2-benzothia-zine-3-carboxyl-ate.

作者信息

Arshad Muhammad Nadeem, Khan Islam Ullah, Zia-Ur-Rehman Muhammad, Shafiq Muhammad, Asiri Abdullah M

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Jul 1;67(Pt 7):o1588-9. doi: 10.1107/S1600536811020289. Epub 2011 Jun 4.

DOI:10.1107/S1600536811020289
PMID:21836997
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3151898/
Abstract

In the title compound, C(17)H(15)NO(5)S, the benzene ring of the fused-ring system is twisted by 11.67 (6)° with respect to the thia-zine ring. The atoms of the four-atom methyl ester group and the phenyl ring of the benzyl unit are inclined at 16.50 (7) and 44.52 (3)° with respect to the thia-zine ring. An intra-molecular O-H⋯O hydrogen bond gives rise to a six-membered S(6) ring motif. In the crystal, mol-ecules are extended through a C-H⋯O inter-action along the a axis. C-H⋯π inter-actions are also observed.

摘要

在标题化合物C₁₇H₁₅NO₅S中,稠环体系的苯环相对于噻嗪环扭转了11.67 (6)°。四原子甲酯基团的原子和苄基单元的苯环相对于噻嗪环的倾斜角度分别为16.50 (7)°和44.52 (3)°。分子内的O—H⋯O氢键形成了一个六元S(6)环结构。在晶体中,分子通过沿a轴的C—H⋯O相互作用延伸。还观察到了C—H⋯π相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/88ba/3151898/ff6dbfca6593/e-67-o1588-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/88ba/3151898/5fe420f44a73/e-67-o1588-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/88ba/3151898/ff6dbfca6593/e-67-o1588-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/88ba/3151898/5fe420f44a73/e-67-o1588-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/88ba/3151898/ff6dbfca6593/e-67-o1588-fig2.jpg

相似文献

1
Methyl 2-benzyl-4-hy-droxy-1,1-dioxo-1,2,3,4-tetra-hydro-1λ,2-benzothia-zine-3-carboxyl-ate.2-苄基-4-羟基-1,1-二氧代-1,2,3,4-四氢-1λ,2-苯并噻嗪-3-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2011 Jul 1;67(Pt 7):o1588-9. doi: 10.1107/S1600536811020289. Epub 2011 Jun 4.
2
Methyl 4-hy-droxy-1,1-dioxo-2-(2-phenyl-eth-yl)-2H-1λ,2-benzothia-zine-3-carboxyl-ate.4-羟基-1,1-二氧代-2-(2-苯乙基)-2H-1λ,2-苯并噻嗪-3-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2011 Dec 1;67(Pt 12):o3445. doi: 10.1107/S160053681104966X. Epub 2011 Nov 25.
3
Methyl 2-butyl-4-hy-droxy-1,1-dioxo-2H-1,2-benzothia-zine-3-carboxyl-ate.2-丁基-4-羟基-1,1-二氧代-2H-1,2-苯并噻嗪-3-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2012 Jun 1;68(Pt 6):o1663. doi: 10.1107/S1600536812019733. Epub 2012 May 5.
4
N-Benzyl-4-hy-droxy-2-methyl-1,1-dioxo-2H-1λ(6),2-benzothia-zine-3-carboxamide.N-苄基-4-羟基-2-甲基-1,1-二氧代-2H-1λ(6),2-苯并噻嗪-3-甲酰胺
Acta Crystallogr Sect E Struct Rep Online. 2012 Jun 1;68(Pt 6):o1921. doi: 10.1107/S1600536812022805. Epub 2012 May 31.
5
Methyl 4-hy-droxy-2-isopropyl-1,1-dioxo-2H-1,2-benzothia-zine-3-carboxyl-ate.4-羟基-2-异丙基-1,1-二氧代-2H-1,2-苯并噻嗪-3-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2011 Jul 1;67(Pt 7):o1823-4. doi: 10.1107/S1600536811024573. Epub 2011 Jun 25.
6
Methyl 2-(but-3-en-yl)-4-hy-droxy-1,1-dioxo-2H-1λ(6),2-benzothia-zine-3-carboxyl-ate.2-(3-丁烯基)-4-羟基-1,1-二氧代-2H-1λ(6),2-苯并噻嗪-3-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2012 Jun 1;68(Pt 6):o1926. doi: 10.1107/S1600536812022908. Epub 2012 May 31.
7
4-Hy-droxy-2-methyl-1,1-dioxo-N-phenyl-2H-1λ(6),2-benzothia-zine-3-carboxamide.4-羟基-2-甲基-1,1-二氧代-N-苯基-2H-1λ(6),2-苯并噻嗪-3-甲酰胺
Acta Crystallogr Sect E Struct Rep Online. 2012 Jun 1;68(Pt 6):o1790. doi: 10.1107/S1600536812021708. Epub 2012 May 19.
8
Methyl 4-hy-droxy-2-meth-oxy-carbonyl-methyl-1,1-dioxo-1,2-dihydro-1λ,2-benzothia-zine-3-carboxyl-ate.4-羟基-2-甲氧羰基甲基-1,1-二氧代-1,2-二氢-1λ,2-苯并噻嗪-3-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2011 Sep 1;67(Pt 9):o2527. doi: 10.1107/S1600536811034921. Epub 2011 Aug 31.
9
4-Hy-droxy-2-methyl-1,1-dioxo-2H-1λ,2- benzothia-zine-3-carb-oxy-lic acid hemihydrate.4-羟基-2-甲基-1,1-二氧代-2H-1λ,2-苯并噻嗪-3-羧酸半水合物
Acta Crystallogr Sect E Struct Rep Online. 2012 Mar 1;68(Pt 3):o621-2. doi: 10.1107/S1600536812004291. Epub 2012 Feb 4.
10
2-(3-Benzoyl-4-hy-droxy-1,1-dioxo-2H-1λ,2-benzothia-zin-2-yl)-1-phenyl-ethanone.2-(3-苯甲酰基-4-羟基-1,1-二氧代-2H-1λ,2-苯并噻嗪-2-基)-1-苯基乙酮
Acta Crystallogr Sect E Struct Rep Online. 2012 Jan;68(Pt 1):o92. doi: 10.1107/S1600536811052615. Epub 2011 Dec 10.

引用本文的文献

1
Methyl 4-hy-droxy-1,1-dioxo-2-(2-phenyl-eth-yl)-2H-1λ,2-benzothia-zine-3-carboxyl-ate.4-羟基-1,1-二氧代-2-(2-苯乙基)-2H-1λ,2-苯并噻嗪-3-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2011 Dec 1;67(Pt 12):o3445. doi: 10.1107/S160053681104966X. Epub 2011 Nov 25.

本文引用的文献

1
Methyl 2-allyl-4-hydr-oxy-2H-1,2-benzothia-zine-3-carboxyl-ate 1,1-dioxide.2-烯丙基-4-羟基-2H-1,2-苯并噻嗪-3-羧酸甲酯 1,1-二氧化物
Acta Crystallogr Sect E Struct Rep Online. 2009 Nov 14;65(Pt 12):o3077. doi: 10.1107/S160053680904673X.
2
Structure validation in chemical crystallography.化学晶体学中的结构验证
Acta Crystallogr D Biol Crystallogr. 2009 Feb;65(Pt 2):148-55. doi: 10.1107/S090744490804362X. Epub 2009 Jan 20.
3
A short history of SHELX.SHELX简史。
Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.
4
Synthesis of potential biologically active 1,2-benzothiazin-3-yl-quinazolin-4(3H)-ones.潜在生物活性1,2-苯并噻嗪-3-基喹唑啉-4(3H)-酮的合成
Chem Pharm Bull (Tokyo). 2006 Aug;54(8):1175-8. doi: 10.1248/cpb.54.1175.