2-（3-氧代-3,4-二氢-2H-1,4-苯并噻嗪-4-基）乙酰胺
2-(3-Oxo-3,4-dihydro-2H-1,4-benzothia-zin-4-yl)acetamide.
作者信息
Saeed Azher, Mahmood Zaid, Yang Shiyao, Salim Muhammad, Akhtar Muhammad Saleem
出版信息
Acta Crystallogr Sect E Struct Rep Online. 2010 Sep 15;66(Pt 10):o2567. doi: 10.1107/S1600536810036305.
Abstract
In the title compound, C(10)H(10)N(2)O(2)S, the thia-zine ring approximates to an envelope form with the S atom in the flap position. The amide group attached to the acetate group is almost perpendicular to the mean plane of the thia-zine ring [dihedral angle = 88.83 (8)°]. In the crystal, inversion dimers linked by pairs of N-H⋯O hydrogen bonds occur. Further N-H⋯O and C-H⋯O hydrogen bonds link the dimers into a three-dimensional network.
摘要
在标题化合物C₁₀H₁₀N₂O₂S中，噻嗪环近似于信封形式，硫原子处于折叶位置。连接到乙酸酯基团上的酰胺基团几乎垂直于噻嗪环的平均平面[二面角 = 88.83 (8)°]。在晶体中，通过N—H⋯O氢键对形成反演二聚体。进一步的N—H⋯O和C—H⋯O氢键将二聚体连接成三维网络。
相似文献
1
2-(3-Oxo-3,4-dihydro-2H-1,4-benzothia-zin-4-yl)acetamide.2-（3-氧代-3,4-二氢-2H-1,4-苯并噻嗪-4-基）乙酰胺
Acta Crystallogr Sect E Struct Rep Online. 2010 Sep 15;66(Pt 10):o2567. doi: 10.1107/S1600536810036305.
2
2-(3-Oxo-3,4-dihydro-2H-1,4-benzothia-zin-4-yl)acetohydrazide.2-（3-氧代-3,4-二氢-2H-1,4-苯并噻嗪-4-基）乙酰肼
Acta Crystallogr Sect E Struct Rep Online. 2010 Aug 11;66(Pt 9):o2289-90. doi: 10.1107/S1600536810031272.
3
Crystal structure of (E)-2-benzyl-idene-4-[(3-phenyl-4,5-di-hydro-isoxazol-5-yl)meth-yl]-2H-benzo[b][1,4]thia-zin-3(4H)-one.（E）-2-苄叉基-4-[(3-苯基-4,5-二氢异恶唑-5-基)甲基]-2H-苯并[b][1,4]噻嗪-3(4H)-酮的晶体结构
Acta Crystallogr E Crystallogr Commun. 2015 May 23;71(Pt 6):o423-4. doi: 10.1107/S2056989015009755. eCollection 2015 Jun 1.
4
3-Chloro-1-methyl-4-[2-(3-phenyl-allyl-idene)hydrazinyl-idene]-3,4-dihydro-1H-2λ(6),1-benzothia-zine-2,2-dione.3-氯-1-甲基-4-[2-(3-苯基-亚烯丙基)肼叉]-3,4-二氢-1H-2λ(6),1-苯并噻嗪-2,2-二酮
Acta Crystallogr Sect E Struct Rep Online. 2013 Feb 1;69(Pt 2):o165. doi: 10.1107/S1600536812051513. Epub 2013 Jan 4.
5
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.
6
2-[1,1-Dioxo-2-(2,4,5-trifluoro-benz-yl)-2H-1,2-benzothia-zin-4-yl]acetic acid.2-[1,1-二氧代-2-(2,4,5-三氟苄基)-2H-1,2-苯并噻嗪-4-基]乙酸
Acta Crystallogr Sect E Struct Rep Online. 2012 May 1;68(Pt 5):o1364. doi: 10.1107/S1600536812015942. Epub 2012 Apr 13.
7
2-{[2-(1-Methyl-2,2-dioxo-3,4-dihydro-1H-2λ(6),1-benzothia-zin-4-yl-idene)hydrazin-1-yl-idene]meth-yl}phenol.2-{[2-(1-甲基-2,2-二氧代-3,4-二氢-1H-2λ(6),1-苯并噻嗪-4-亚基)肼-1-亚基]甲基}苯酚
Acta Crystallogr Sect E Struct Rep Online. 2012 Sep 1;68(Pt 9):o2643. doi: 10.1107/S1600536812034101. Epub 2012 Aug 4.
8
2-(3,4-Dimethyl-5,5-dioxo-2H,4H-pyrazolo-[4,3-c][1,2]benzothia-zin-2-yl)-N-(3-meth-oxy-benz-yl)acetamide.2-（3,4-二甲基-5,5-二氧代-2H,4H-吡唑并-[4,3-c][1,2]苯并噻嗪-2-基）-N-（3-甲氧基-苄基）乙酰胺
Acta Crystallogr Sect E Struct Rep Online. 2012 Nov 1;68(Pt 11):o3064-5. doi: 10.1107/S1600536812040226. Epub 2012 Oct 3.
9
Crystal structure of (E)-2-cyano-3-(12-methyl-12H-benzo[b]pheno-thia-zin-11-yl)acrylic acid.（E）-2-氰基-3-（12-甲基-12H-苯并[b]吩噻嗪-11-基）丙烯酸的晶体结构
Acta Crystallogr Sect E Struct Rep Online. 2014 Aug 20;70(Pt 9):o1026-7. doi: 10.1107/S1600536814018388. eCollection 2014 Sep 1.
10
2-(3,4-Dimethyl-5,5-dioxo-2H,4H-pyrazolo-[4,3-c][1,2]benzothia-zin-2-yl)-N-(2-fluoro-benz-yl)acetamide.2-（3,4-二甲基-5,5-二氧代-2H,4H-吡唑并-[4,3-c][1,2]苯并噻嗪-2-基）-N-（2-氟苄基）乙酰胺
Acta Crystallogr Sect E Struct Rep Online. 2012 Aug 1;68(Pt 8):o2470-1. doi: 10.1107/S160053681203187X. Epub 2012 Jul 18.
引用本文的文献
1
Development and Characterization of Novel Selective, Non-Basic Dopamine D Receptor Antagonists for the Treatment of Schizophrenia.新型选择性、非碱性多巴胺 D 受体拮抗剂的开发与表征及其在精神分裂症治疗中的应用。
Molecules. 2023 May 20;28(10):4211. doi: 10.3390/molecules28104211.
本文引用的文献
1
2-(3-Oxo-3,4-dihydro-2H-1,4-benzothia-zin-4-yl)acetohydrazide.2-（3-氧代-3,4-二氢-2H-1,4-苯并噻嗪-4-基）乙酰肼
Acta Crystallogr Sect E Struct Rep Online. 2010 Aug 11;66(Pt 9):o2289-90. doi: 10.1107/S1600536810031272.
2
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.
Zotero 插件