KS2CN(CH2CH=CH2)2 | 94078-02-1

• 分子结构分类: 有机化合物 - 有机盐 - 有机金属盐
• 英文名称: KS2CN(CH2CH=CH2)2
• 英文别名: potassium;N,N-bis(prop-2-enyl)carbamodithioate
• CAS: 94078-02-1
• 化学式: C₇H₁₀NS₂*K
• 分子量: 211.393
• InChiKey: JOZQJZXIKDFIEH-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -1.5
• 重原子数：
  11
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  36.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  KS2CN(CH2CH=CH2)2 在 盐酸 、 sodium acetate 、 一水合肼 作用下， 以 甲醇 、 乙醇 、 水 为溶剂， 反应 1.5h， 生成 3-(Benzhydrylideneamino)-1,1-bis(prop-2-enyl)thiourea
  参考文献：
  名称：

  Novel antitubercular diallyl/dibenzylthiosemicarbazones endowed with high activity toward multi-drug-resistant tuberculosis

  摘要：

  Novel diallyl and dibenzylthiosemicarbazones were prepared by three-step reactions. The compounds were tested for their in vitro activity against Mycobacterium tuberculosis H37Rv (MTB) and multi-drug-resistant Mycobacterium tuberculosis (MDR-TB). Most of the compounds showed excellent activity toward MDR-TB. Among the thirty compounds (4,5a-o) tested N,N-dibenzyl-2-((5-nitrofuran-2-yl)methylene)hydrazinecarbothioamide (5g) was found to be the most potent compound MICs of 0.55 and 0.12 mu M against MTB and MDR-TB.

  DOI：

  10.1007/s00044-011-9638-9
• 作为产物：
  描述：

  二硫化碳 、 二烯丙基胺 在 potassium hydroxide 作用下， 以 水 为溶剂， 生成 KS2CN(CH2CH=CH2)2
  参考文献：
  名称：

  基于金（I）的二烯丙基二硫代氨基甲酸酯配合物的闭环易位和纳米粒子形成：合成，结构和计算研究

  摘要：

  金（I）络合物[金{S 2 CN（CH 2 CH = CH 2）2 }（L）] [L = PPH 3，PCY 3，PME 3，CN吨卜，IDIP]从KS制备2 CN （CH 2 CH = CH 2）2和[（L）AUCL]。化合物[L 2（AUCL）2 ]（L 2 = DPPA，DPPF）产率[（L 2）{AUS 2 CN（CH 2 CH = CH 2）2 } 2 ]，而环状配合物[（DPPM）{金2 S 2CN（CH 2 CH = CH 2）2 }]光学传递函数是从[DPPM（AUCL）得到2 ]和的AgOTf随后KS 2 CN（CH 2 CH = CH 2）2。化合物[金2 {S 2 CN（CH 2 CH = CH 2）2 } 2 ]由制备[（THT）AUCL]（THT =四氢噻吩）和diallyldithiocarbamate配体。该产物与[Ru（═CHPh）Cl 2（SIMes）（PCy

  DOI：

  10.1021/ic402048a

文献信息

• THIOL-CONTAINING COMPOUNDS FOR THE REMOVAL OF ELEMENTS FROM CONTAMINATED MILIEU AND METHODS OF USE
  申请人：Haley Boyd E.

  公开号：US20110076246A1

  公开（公告）日：2011-03-31

  Sulfur-containing ligands and methods of their utilization for binding metals and/or main group elements and removing them from fluids, solids, gases and/or tissues are disclosed. The ligands are of the general structure: where R 1 comprises benzene, pyridine, pyridin-4-one, naphthalene, anthracene, phenanthrene or alkyl groups, R 2 comprises hydrogen, alkyls, aryls, a carboxyl group, carboxylate esters, organic groups or biological groups, R 3 comprises alkyls, aryls, a carboxyl group, carboxylate esters, organic groups or biological groups, X comprises hydrogen, lithium, sodium, potassium, rubidium, cesium, francium, alkyls, aryls, a carboxyl group, carboxylate esters, thiophosphate, N-acetyl cysteine, mercaptoacetic acid, mercaptopropionic acid, thiolsalicylate, organic groups or biological groups, n independently equals 1-10, m=1-6, Y comprises hydrogen, polymers, silicas or silica supported substrates, and Z comprises hydrogen, alkyls, aryls, a carboxyl group, carboxylate esters, a hydroxyl group, NH 2 , HSO 3 , halogens, a carbonyl group, organic groups, biological groups, polymers, silicas or silica supported substrates.

  含硫配体及其在结合金属和/或主族元素并从流体、固体、气体和/或组织中去除它们的方法已被披露。这些配体具有一般结构：其中R1包括苯、吡啶、吡啶-4-酮、萘、蒽、菲或烷基，R2包括氢、烷基、芳基、羧基、羧酸酯、有机基团或生物基团，R3包括烷基、芳基、羧基、羧酸酯、有机基团或生物基团，X包括氢、锂、钠、钾、铷、铯、钫、烷基、芳基、羧基、羧酸酯、硫代磷酸酯、N-乙酰半胱氨酸、巯基乙酸、巯基丙酸、巯基水杨酸盐、有机基团或生物基团，n独立地等于1-10，m=1-6，Y包括氢、聚合物、硅或硅支撑基质，Z包括氢、烷基、芳基、羧基、羧酸酯、羟基、NH2、HSO3、卤素、羰基、有机基团、生物基团、聚合物、硅或硅支撑基质。
• Syntheses of Novel Fe/S Clusters with μ-Aminocarbyne Ligands
  作者：Yao-Cheng Shi、Qiang Fu

  DOI：10.1002/zaac.201300192

  日期：2013.8

  thus-obtained solution with MeI and PhCH2Br afforded clusters 1, (μ-MeS)Fe2(CO)6(μ4-S)Fe2(CO)6(μ-CN(C3H5)2), and 2, (μ-PhCH2CO)Fe2(CO)6(μ4-S)Fe2(CO)6(μ-CN(C3H5)2). Their structures were unambiguously determined by X-ray crystallography. Therefore, this methodology provides a novel route for the syntheses of spiro-S Fe/S clusters with aminocarbyne ligands.

  Fe3(CO)12 与 (C3H5)2NCS2K 在 THF 中在室温下反应得到红棕色溶液。用 MeI 和 PhCH2Br 处理由此获得的溶液得到簇 1，(μ-MeS)Fe2(CO)6(μ4-S)Fe2(CO)6(μ-CN(C3H5)2)，和 2，(μ -PhCH2CO)Fe2(CO)6(μ4-S)Fe2(CO)6(μ-CN(C3H5)2)。它们的结构由 X 射线晶体学明确确定。因此，该方法为合成具有氨基碳炔配体的spiro-S Fe/S簇提供了一种新途径。
• BASIC METAL SALT OF DITHIOCARBAMIC ACID AND LUBRICATING OIL COMPOSITION CONTAINING SAID SALT
  申请人：Tonen Corporation

  公开号：EP0737675A1

  公开（公告）日：1996-10-16

  A novel basic metal salt of a dithiocarbamic acid represented by general formula (1) and having a basic component content (=ax3x100) of 30-100 mol %. In formula (1) R1 to R4 represent each independently a C1-C30 lipophilic group; M represents a metal atom selected from among zinc, copper, nickel, iron, cadmium, silver, lead, antimony, tin and bismuth; and a represents a coefficient in the range of 1/3 to 1/10, which salt does not contain phosphorus and can impart an excellent wear resistance when used as a lubricating oil additive; and a lubricating oil composition comprising a lube base oil and the above metal salt, excellent in wear resistance and friction characteristics, and particularly suitable as a lubricating oil for automotive internal-combustion engines.

  一种由通式（1）表示的二硫代氨基甲酸的新型碱性金属盐，其碱性成分含量（=ax3x100）为 30-100 摩尔%。在式 (1) 中，R1 至 R4 分别独立地代表一个 C1-C30 亲脂基团；M 代表一个选自锌、铜、镍、铁、镉、银、铅、锑、锡和铋的金属原子；a 代表一个在 1/3 至 1/10 范围内的系数，该盐不含磷，用作润滑油添加剂时可赋予其优异的耐磨性；以及由润滑油基础油和上述金属盐组成的润滑油组合物，具有优异的耐磨性和摩擦特性，特别适合用作汽车内燃机的润滑油。
• Novel multidentate sulfur-containing ligands
  申请人：——

  公开号：US20020100732A1

  公开（公告）日：2002-08-01

  Novel sulfur-containing ligands for binding of heavy metals are disclosed. The ligands incorporate a central ring structure and pendant alkyl-thiol chains. The ligands are of the general structure: 1 where n is an integer from 1-4, and X is selected from the group consisting of hydrogen, lithium, sodium, potassium, rubidium, cesium, and francium. The ligands of the present invention are suitable for binding any metal in or capable of being placed in a positive oxidation state, such as cadmium, lead, nickel, zinc, mercury, copper, and the like. Additionally, methods for removal of heavy metals from various substances are disclosed, comprising separating selected heavy metals from selected substances by contacting the substances with an effective amount of the novel sulfur-containing chelate ligands for a sufficient time to form stable, irreversible ligand-metal precipitates, and removing such precipitates.

  本研究公开了用于结合重金属的新型含硫配体。这些配体包含一个中心环结构和悬挂的烷基硫醇链。配体的一般结构如下 1 其中 n 为 1-4 的整数，X 选自氢、锂、钠、钾、铷、铯和钫组成的组。本发明的配体适用于结合任何处于或能够处于正氧化态的金属，如镉、铅、镍、锌、汞、铜等。此外，本发明还公开了从各种物质中去除重金属的方法，包括将选定的重金属从选定的物质中分离出来，方法是将这些物质与有效量的新型含硫螯合配体接触足够长的时间，以形成稳定的、不可逆的配体-金属沉淀物，然后去除这些沉淀物。
• Diversity-oriented synthesis of novel sulfonated piperazine derivatives endowing dual biological activities
  作者：Azim Ziyaei Halimehjani、Sahar Bayat、Seyyed Emad Hooshmand、Gholamhossein Tondro、Hamid Reza Moradi、Jafar Jalaei

  DOI：10.1016/j.molstruc.2024.138263

  日期：2024.8

  diversity-oriented synthesis of sulfonated piperazine derivatives containing dithiocarbamates, thiol and azide functional groups was developed via DABCO CN bond cleavage. In this synthetic strategy, quaternized DABCO salts were synthesized using sultones and reacted with various nucleophiles namely dithiocarbamates, thiols and sodium azide to afford the target functionalized sulfonated piperazines derivatives in moderate

  通过DABCO CN键断裂，开发了一种无催化剂合成路线，用于多样性导向合成含有二硫代氨基甲酸酯、硫醇和叠氮化物官能团的磺化哌嗪衍生物。在该合成策略中，使用磺内酯合成季铵化 DABCO 盐，并与各种亲核试剂（即二硫代氨基甲酸酯、硫醇和叠氮化钠）反应，以中等至优异的产率提供目标官能化磺化哌嗪衍生物。这是第一篇关于使用磺内酯作为 DABCO 键断裂活化剂的报道。最后，通过圆盘融合和微量稀释方法检测，随后的产品对革兰氏阳性和革兰氏阴性细菌（如 和 ）显示出可接受的抗菌活性。更重要的是，一些有保证的产品同时表现出对神经胶质瘤的作用，但对哺乳动物细胞的杀伤作用可以忽略不计。