(E)-(N'-(2,6-dimethylphenyl)N-(4-(1-(4-(trifluoromethyloxy)phenyl)-1H-1,2,4-triazol-3-yl)phenylcarbamoyl)carbamimidoylthio)methyl isobutyrate | 1417911-08-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: (E)-(N'-(2,6-dimethylphenyl)N-(4-(1-(4-(trifluoromethyloxy)phenyl)-1H-1,2,4-triazol-3-yl)phenylcarbamoyl)carbamimidoylthio)methyl isobutyrate
• 英文别名: (E)-((N'-(2,6-dimethylphenyl)-N-((4-(1-(4-(trifluoromethoxy)phenyl)-1H-1,2,4-triazol-3-yl)phenyl)carbamoyl)carbamimidoyl)thio)methyl isobutyrate；[(E)-N-(2,6-dimethylphenyl)-N'-[[4-[1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]phenyl]carbamoyl]carbamimidoyl]sulfanylmethyl 2-methylpropanoate
• CAS: 1417911-08-0
• 化学式: C₃₀H₂₉F₃N₆O₄S
• 分子量: 626.659
• InChiKey: DLNOXABCJJHPRJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.8
• 重原子数：
  44
• 可旋转键数：
  11
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  145
• 氢给体数：
  2
• 氢受体数：
  11

反应信息

• 作为反应物：
  描述：

  (E)-(N'-(2,6-dimethylphenyl)N-(4-(1-(4-(trifluoromethyloxy)phenyl)-1H-1,2,4-triazol-3-yl)phenylcarbamoyl)carbamimidoylthio)methyl isobutyrate 在 盐酸 、 potassium carbonate 作用下， 以 甲醇 、 丙酮 为溶剂， 反应 41.0h， 生成 (Z)-2-((2,6-dimethylphenyl)imino)-N-(4-(1-(4-(trifluoromethoxy)phenyl)-1H-1,2,4-triazol-3-yl)phenyl)thiazolidine-3-carboxamide
  参考文献：
  名称：

  [EN] PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO
  [FR] COMPOSITIONS PESTICIDES ET PROCÉDÉS CORRESPONDANTS

  摘要：

  这份文件公开了具有以下公式（“公式一”）的分子。本文档中披露的分子与生产作为农药（例如，杀螨剂、杀虫剂、杀软体动物剂和杀线虫剂）有用的分子的过程领域有关，以及这些分子，以及使用这些分子控制害虫的过程。

  公开号：

  WO2014011429A1

文献信息

• [EN] PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO<br/>[FR] COMPOSITIONS PESTICIDES ET PROCÉDÉS RELATIFS À CES COMPOSITIONS
  申请人：DOW AGROSCIENCES LLC

  公开号：WO2013009791A1

  公开（公告）日：2013-01-17

  This document discloses molecules having the following formula ("Formula One") The molecules disclosed in this document are related to the field of processes to produce molecules that are useful as pesticides (e.g., acaricides, insecticides, molluscicides, and nematicides), such molecules, and processes of using such molecules to control pests.

  这份文件公开了具有以下公式（“公式一”）的分子。本文档中披露的分子与生产作为农药（例如，杀螨剂、杀虫剂、杀软体动物剂和杀线虫剂）有用的分子的过程领域有关，以及这样的分子和使用这样的分子控制害虫的过程。
• PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO
  申请人：Crouse Gary D.

  公开号：US20130019348A1

  公开（公告）日：2013-01-17

  This document discloses molecules having the following formula (“Formula One”) The molecules disclosed in this document are related to the field of processes to produce molecules that are useful as pesticides (e.g., acaricides, insecticides, molluscicides, and nematicides), such molecules, and processes of using such molecules to control pests.

  本文件揭示了具有以下式子（“公式一”）的分子。本文件中所揭示的分子与生产可用作杀虫剂（例如，杀螨剂、杀虫剂、杀螺剂和杀线虫剂）的分子的过程相关，以及使用这些分子来控制害虫的过程。
• [EN] PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO<br/>[FR] COMPOSITIONS PESTICIDES ET PROCÉDÉS ASSOCIÉS
  申请人：DOW AGROSCIENCES LLC

  公开号：WO2013019824A3

  公开（公告）日：2014-05-08
• MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO
  申请人：Dow Agrosciences LLC

  公开号：EP3347341B1

  公开（公告）日：2021-04-28
• Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto
  申请人：Dow AgroSciences LLC

  公开号：US20170073316A1

  公开（公告）日：2017-03-16

  This disclosure relates to the field of molecules having pesticidal utility against pests in Phyla Arthropoda, Mollusca, and Nematoda, processes to produce such molecules, intermediates used in such processes, pesticidal compositions containing such molecules, and processes of using such pesticidal compositions against such pests. These pesticidal compositions may be used, for example, as acaricides, insecticides, miticides, molluscicides, and nematicides. This document discloses molecules having the following formula (“Formula One”).