1-benzyl-3-ethylthiourea | 2741-08-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1-benzyl-3-ethylthiourea
• 英文别名: N-ethyl-N'-benzyl-thiourea；N-Aethyl-N'-benzyl-thioharnstoff；1-ethyl-3-benzyl thiourea；N-Benzyl-N'-ethyl-thioharnstoff；1-Ethyl-3-benzyl-thioharnstoff
• CAS: 2741-08-4
• 化学式: C₁₀H₁₄N₂S
• mdl: MFCD00463376
• 分子量: 194.301
• InChiKey: RIXUXULYJVAPIX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  13
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  56.2
• 氢给体数：
  2
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  1-benzyl-3-ethylthiourea 在 lead(II) oxide 作用下， 以 丙酮 为溶剂， 生成 1-Benzyl-3-ethyl-carbodiimid
  参考文献：
  名称：

  Indukumari, P. V.; Joshua, C. P., Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1980, vol. 19, # 8, p. 667 - 671

  摘要：

  DOI：
• 作为产物：
  描述：

  N,N'-Diethyl-thiuramdisulfid 、 苄胺 以 乙醇 为溶剂， 生成 1-benzyl-3-ethylthiourea
  参考文献：
  名称：

  Nair,G.V., Journal of the Indian Chemical Society, 1965, vol. 42, p. 359 - 366

  摘要：

  DOI：

文献信息

• Electrogenerated base-promoted synthesis and antimicrobial activity of 2-imino-1,3-thiazolidin-4-one derivatives
  作者：Beya Haouas、Taieb Saied、Hanen Ayari、Youssef Arfaoui、Mohamed Lamine Benkhoud、Khaled Boujlel

  DOI：10.1080/17415993.2016.1155588

  日期：2016.7.3

  of dry acetonitrile at a steel grid cathode were used to promote the addition of ethyl bromoacetate to thiourea derivatives. The reaction yields the corresponding 2-imino-1,3-thiazolidin-4-one. The reaction pathway was discussed based on the kinetic and thermodynamic data obtained by computational methods. In addition, the biological activity of these new compounds was also investigated. GRAPHICAL ABSTRACT

  摘要 通过在钢栅阴极还原干乙腈获得的电生成的氰基甲基阴离子用于促进溴乙酸乙酯向硫脲衍生物的添加。该反应产生相应的 2-imino-1,3-thiazolidin-4-one。基于通过计算方法获得的动力学和热力学数据讨论了反应途径。此外，还研究了这些新化合物的生物活性。图形概要
• EGB-promoted electrochemical synthesis of 6-thioxo-[1,3,5]-triazinane-2,4 dione derivatives
  作者：Najoua Sbei、Baya Haouas、Khaled Boujlel、Belen Batanero、Mohamed Lamine Benkhoud

  DOI：10.1080/00397911.2016.1166251

  日期：2016.4.17

  electroreduction of neat acetonitrile assisted the reaction between thiourea derivatives and alkyl or aryl isocyanate. This protocol had the advantage of giving good yields using mild conditions. The obtained products have been identified by spectroscopic data, mass spectrometry, and high-resolution mass spectra or elemental analysis. GRAPHICAL ABSTRACT

  摘要报道了一种合成 6-thioxo-[1,3,5]-triazinane-2,4-dione 衍生物的简单方法。从纯乙腈的电还原获得的电生成的氰甲基碱有助于硫脲衍生物与烷基或芳基异氰酸酯之间的反应。该协议的优点是使用温和的条件提供良好的产量。所得产物经光谱数据、质谱、高分辨质谱或元素分析鉴定。图形概要
• Biocidal isothiourea compounds
  申请人：Stauffer Chemical Company

  公开号：US04233318A1

  公开（公告）日：1980-11-11

  Novel biocidal S-aminoalkyl isothiourea compounds have the general structural formula ##STR1## wherein X is halogen; R is a straight or branched chain alkyl radical containing 5 to 20 carbon atoms; R.sub.1 is selected from the group consisting of alkyl containing 1 to 20 carbon atoms, alkenyl containing 2 to 6 carbon atoms, benzyl, halo substituted benzyl, .alpha.-methyl benzyl, furfuryl and pyridyl methyl; R.sub.2 is hydrogen or alkyl containing 1 to 10 carbon atoms; R.sub.3 and R.sub.4 are independently hydrogen or alkyl containing 1 to 4 carbon atoms; and R.sub.5 is divalent alkylene containing 2 to 4 carbon atoms.

  新型生物杀菌S-氨基烷基异硫脲化合物具有以下一般结构式##STR1##其中X为卤素；R为含有5至20个碳原子的直链或支链烷基基团；R.sub.1选自由含有1至20个碳原子的烷基、含有2至6个碳原子的烯基、苄基、卤素取代的苄基、α-甲基苄基、呋喃基和吡啶基甲基的基团；R.sub.2为氢或含有1至10个碳原子的烷基；R.sub.3和R.sub.4独立地为氢或含有1至4个碳原子的烷基；R.sub.5为含有2至4个碳原子的二价烷基。
• N-Heterocyclic Phosphines
  申请人：The Board of Regents of the Nevada System of Higher Education on Behalf of the Unive. of Nevada

  公开号：US20180118770A1

  公开（公告）日：2018-05-03

  Provided herein are N-heterocyclic phosphines (NHPs) useful in metal-free phosphorus-carbon bond forming reactions. Methods for preparing vinylphosphonates using NHPs also are provided. This abstract is intended as a scanning tool for purposes of searching in the particular art and is not intended to be limiting of the present invention.

  本文提供了一种在无金属条件下进行磷-碳键形成反应中有用的N-杂环膦（NHPs）。还提供了使用NHPs制备乙烯磷酸酯的方法。本摘要旨在作为在特定领域搜索的扫描工具，不限制本发明。
• Efficient synthetic procedure to new 2-imino-1,3-thiazolines and thiazolidin-4-ones promoted by acetonitrile electrogenerated base
  作者：Beya Haouas、Najwa Sbei、Hana Ayari、M. Lamine Benkhoud、Belen Batanero

  DOI：10.1039/c8nj01992d

  日期：——

  A novel and convenient strategy is described for the regioselective conversion of N,N′-disubstituted thioureas and 1,2-dielectrophiles into the highly biologically valuable 2-imino-thiazoline and 2-imino thiazolidine-4-one derivatives. The synthesis proceeds through a process with good yield promoted by an electrogenerated base (EGB) obtained with high current efficiency.

  描述了一种新颖且方便的策略，用于将N，N'-二取代的硫脲和1,2-二亲电试剂区域选择性地转化为具有高度生物学价值的2-亚氨基噻唑啉和2-亚氨基噻唑烷-4-酮衍生物。合成通过以高电流效率获得的电生成碱（EGB）促进的高收率工艺进行。