N-allyloxy-5-benzylthio-1-methylpyrazole-4-carboxylic acid amide | 868681-38-3

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: N-allyloxy-5-benzylthio-1-methylpyrazole-4-carboxylic acid amide
• 英文别名: 5-benzylsulfanyl-1-methyl-N-prop-2-enoxypyrazole-4-carboxamide
• CAS: 868681-38-3
• 化学式: C₁₅H₁₇N₃O₂S
• 分子量: 303.385
• InChiKey: DOIPDTBCYUILMO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  21
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  81.4
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  N-allyloxy-5-benzylthio-1-methylpyrazole-4-carboxylic acid amide 在 碘 作用下， 以 乙腈 为溶剂， 反应 8.0h， 生成 5-benzylthio-4-(5-iodomethyl-5H,6H-1,4,2-dioxazin-3-yl)-1-methylpyrazole
  参考文献：
  名称：

  EP1748047

  摘要：

  公开号：
• 作为产物：
  描述：

  5-benzylthio-1-methylpyrazole-4-carbohydroxamic acid 、 3-溴丙烯 在 potassium carbonate 作用下， 以 水 、 甲苯 为溶剂， 反应 4.0h， 生成 N-allyloxy-5-benzylthio-1-methylpyrazole-4-carboxylic acid amide
  参考文献：
  名称：

  EP1748047

  摘要：

  公开号：

文献信息

• Pyrazole Sulfonylurea Compound and Herbicide
  申请人：Kita Hiroshi

  公开号：US20080064600A1

  公开（公告）日：2008-03-13

  There is provided a novel herbicide. A pyrazole sulfonylurea compound of formula (1): wherein R 1 is C 1-3 alkyl, etc., R 2 is hydrogen atom, C 1-3 alkyl, C 1-3 haloalkyl, etc., R 3 , R 4 , R 5 and R 6 independently of one another are hydrogen atom, C 1-3 alkyl, etc., with a proviso that at least one of R 3 , R 4 , R 5 and R 6 is C 1-3 alkyl or C 1-3 haloalkyl, X and Y independently of each other are C 1-3 alkyl, etc., Z is nitrogen atom or methyne, and a salt thereof that is acceptable as an agrochemical; an agrochemical containing at least one of the compound and the salt thereof that is acceptable as an agrochemical as an active component, and a herbicide containing at least one of the compound and the salt thereof that is acceptable as an agrochemical as an active component.

  提供了一种新型除草剂。化合物为吡唑磺酰脲类，其化学式为(1)：其中，R1为C1-3烷基等；R2为氢原子、C1-3烷基、C1-3卤代烷基等；R3、R4、R5和R6独立地为氢原子、C1-3烷基等，但其中至少有一个为C1-3烷基或C1-3卤代烷基；X和Y独立地为C1-3烷基等；Z为氮原子或亚甲基；以及其可作为农药的盐。含有该化合物或其可作为农药的盐的农药，作为活性成分的除草剂。
• Pyrazole sulfonylurea compound and herbicide
  申请人：Kita Hiroshi

  公开号：US20100016584A1

  公开（公告）日：2010-01-21

  A pyrazole compound of the formula: where: R 1 is C 1-3 alkyl, C 1-3 haloalkyl, C 1-3 alkoxy C 1-3 alkyl, phenyl or pyridyl; R 2 is a hydrogen atom, C 1-3 alkyl, C 1-3 haloalkyl, C 1-3 alkoxy or a halogen atom; R 3 , R 4 , R 5 and R 6 independently of one another are a hydrogen atom, C 1-3 alkyl or C 1-3 haloalkyl, with a proviso that at least one of R 3 , R 4 , R 5 and R 6 is C 1-3 alkyl or C 1-3 haloalkyl; and L is a hydrogen atom, chlorine atom, SH, benzylthio, chlorosulfonyl, aminosulfonyl, SO 2 N═C═O, SO 2 NHCO 2 CH 3 or SO 2 NHCONHn-C 4 H 9 . A salt of the compound that is acceptable as an agrochemical. An agrochemical containing the compound or the salt thereof as an active component. A herbicide containing the compound or the salt thereof as an active component.

  一种吡唑化合物的化学式如下：其中：R1是C1-3烷基，C1-3卤代烷基，C1-3烷氧基C1-3烷基，苯基或吡啶基; R2是氢原子，C1-3烷基，C1-3卤代烷基，C1-3烷氧基或卤原子; R3，R4，R5和R6独立地是氢原子，C1-3烷基或C1-3卤代烷基，但至少其中一个是C1-3烷基或C1-3卤代烷基; L是氢原子，氯原子，SH，苯甲硫基，氯磺酰基，氨基磺酰基，SO2N═C═O，SO2NHCO2CH3或SO2NHCONHn-C4H9。一种作为农药可接受的化合物盐。一种含有该化合物或其盐作为活性成分的农药。一种含有该化合物或其盐作为活性成分的除草剂。
• PYRAZOLE SULFONYLUREA COMPOUND AND HERBICIDE
  申请人：Nissan Chemical Industries, Ltd.

  公开号：EP1748047A1

  公开（公告）日：2007-01-31

  There is provided a novel herbicide. A pyrazole sulfonylurea compound of formula (1): wherein R1 is C1-3alkyl, etc., R2 is hydrogen atom, C1-3alkyl, C1-3haloalkyl, etc., R3, R4, R5 and R6 independently of one another are hydrogen atom, C1-3alkyl, etc., with a proviso that at least one of R3, R4, R5 and R6 is C1-3alkyl or C1-3haloalkyl, X and Y independently of each other are C1-3alkyl, etc., Z is nitrogen atom or methyne, and a salt thereof that is acceptable as an agrochemical; an agrochemical containing at least one of the compound and the salt thereof that is acceptable as an agrochemical as an active component, and a herbicide containing at least one of the compound and the salt thereof that is acceptable as an agrochemical as an active component.

  本发明提供了一种新型除草剂。一种式（1）的吡唑磺酰脲化合物： 其中R1是C1-3烷基等，R2是氢原子、C1-3烷基、C1-3卤代烷基等，R3、R4、R5和R6彼此独立地是氢原子、C1-3烷基等，但有一个限制性条件，即R3、R4、R5和R6中至少有一个是C1-3烷基或C1-3卤代烷基，X和Y彼此独立地是C1-3烷基等、Z 是氮原子或甲基，以及其可作为农用化学品的盐；含有至少一种该化合物及其盐的农用化学品，其可作为农用化学品的活性成分；以及含有至少一种该化合物及其盐的除草剂，其可作为农用化学品的活性成分。
• US7557067B2
  申请人：——

  公开号：US7557067B2

  公开（公告）日：2009-07-07
• US7709636B2
  申请人：——

  公开号：US7709636B2

  公开（公告）日：2010-05-04