2-(3-cyano-1-propen-1-yl)benzenesulfonamide | 90300-46-2

• 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: 2-(3-cyano-1-propen-1-yl)benzenesulfonamide
• 英文别名: 2-(3-Cyano-1-propen-1-yl)phenylsulfonamide；2-(3-cyanoprop-1-enyl)benzenesulfonamide
• CAS: 90300-46-2
• 化学式: C₁₀H₁₀N₂O₂S
• 分子量: 222.268
• InChiKey: LGTFCTAROCHMSF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.8
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  92.3
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  4-Methoxy-6-methyl-1,3,5-triazin-2-ylphenylcarbamate 、 2-(3-cyano-1-propen-1-yl)benzenesulfonamide 、 1,5-Diazabicyclo[5.4.0]undec-5-ene 、 盐酸 在 乙酸乙酯 、 丙酮 、 乙醚 作用下， 以 1,4-二氧六环 、 水 为溶剂， 反应 15.0h， 生成 N-[2-(3-cyano-1-propen-1-yl)phenylsulfonyl]N'-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea
  参考文献：
  名称：

  N-phenylsulfonyl-N'-pyrimidinylureas

  摘要：

  本发明涉及一般式为##STR1##的N-苯磺酰-N'-嘧啶脲和N-苯磺酰-N-三嗪脲，其中R.sub.1是氢、卤素、硝基、氨基、C.sub.1-C.sub.5烷基、C.sub.1-C.sub.4卤代烷基或--Q--R.sub.7、--CO--OR.sub.8或--(CO).sub.n--NR.sub.9R.sub.10基团，R.sub.2是氢、C.sub.1-C.sub.4烷基、C.sub.1-C.sub.4烷氧基、C.sub.1-C.sub.4烷硫基、C.sub.1-C.sub.4卤代烷基、C.sub.1-C.sub.4卤代烷氧基、卤素或不含有超过4个碳原子的烷氧基烷基，R.sub.3是C.sub.2-C.sub.10烯基，其被一个或多个氟或溴原子或一个或多个羟基、氰基、硝基、--(Y).sub.m--CO--(Z).sub.n--R.sub.8、--SO.sub.2--NR.sub.11R.sub.12、--S(O).sub.P--C.sub.1-C.sub.3卤代烷基或--S(O).sub.n--C.sub.1-C.sub.3烷基基团取代，并且还可以被一个或多个氯原子取代，R.sub.4是C.sub.1-C.sub.3烷基、C.sub.1-C.sub.3卤代烷基、C.sub.1-C.sub.3烷氧基或C.sub.1-C.sub.3卤代烷氧基，R.sub.5是氢、卤素、--NR.sub.13R.sub.14、C.sub.1-C.sub.3烷基、C.sub.1-C.sub.3卤代烷基、C.sub.1-C.sub.3烷氧基或C.sub.1-C.sub.2卤代烷氧基，R.sub.6是氢、C.sub.1-C.sub.3烷基或C.sub.1-C.sub.3烷氧基，X是氧或硫，E是氮或甲基基团，R.sub.7是C.sub.1-C.sub.4烷基，其被卤素或C.sub.1-C.sub.3烷氧基取代或是C.sub.3-C.sub.5烯基，R.sub.8是C.sub.1-C.sub.4烷基、C.sub.1-C.sub.4卤代烷基或C.sub.2-C.sub.6烷氧基烷基，R.sub.9、R.sub.10、R.sub.11、R.sub.12、R.sub.13和R.sub.14各自独立地是氢或C.sub.1-C.sub.3烷基，Q是氧、硫、亚砜基或磺酰基桥，Y是氧、硫或--NR.sub.16--，其中R.sub.16是氢或C.sub.1-C.sub.3烷基，Z是氧、硫或--NR.sub.17--，其中R.sub.17是氢或C.sub.1-C.sub.3烷基，m和n各自为0或1，p为0、1或2，并且这些化合物与胺、碱金属基或碱土金属基的盐具有良好的前和后除草和生长调节性能。

  公开号：

  US05104440A1

文献信息

• N-phenylsulfonyl-N'-triazinylureas
  申请人：Ciba-Geigy Corporation

  公开号：US04780125A1

  公开（公告）日：1988-10-25

  The invention relates to N-phenylsulfonyl-N'-pyrimidinylureas and N-phenylsulfonyl-N-triazinylureas of the general formula ##STR1## wherein R.sub.1 is hydrogen, halogen, nitro, amino, C.sub.1 -C.sub.5 alkyl, C.sub.1 -C.sub.4 haloalkyl or a --Q--R.sub.7, --CO--OR.sub.8 or --(CO).sub.n --NR.sub.9 R.sub.10 radical, R.sub.2 is hydrogen, C.sub.1 -C.sub.4 alkyl, C.sub.1 -C.sub.4 alkoxy, C.sub.1 -C.sub.4 alkylthio, C.sub.1 -C.sub.4 haloalkyl, C.sub.1 -C.sub.4 haloalkoxy, halogen or alkoxyalkyl containing not more than 4 carbon atoms, R.sub.3 is C.sub.2 -C.sub.10 alkenyl which is substituted by one or more fluorine or bromine atoms or by one or more hydroxyl, cyano, nitro, --(Y).sub.m --CO--(Z).sub.n --R.sub.8, --SO.sub.2 --NR.sub.11 R.sub.12, --S(O).sub.p --C.sub.1 --C.sub.3 haloalkyl or --S(O).sub.n --C.sub.1 -C.sub.3 alkyl groups and which may additionally be substituted by one or more chlorine atoms, R.sub.4 is C.sub.1 -C.sub.3 alkyl, C.sub.1 -C.sub.3 haloalkyl, C.sub.1 -C.sub.3 alkoxy or C.sub.1 -C.sub.3 haloalkoxy, R.sub.5 is hydrogen, halogen, --NR.sub.13 R.sub.14, C.sub.1 -C.sub.3 alkyl, C.sub.1 -C.sub.3 haloalkyl, C.sub.1 -C.sub.3 alkoxy or C.sub.1 -C.sub.2 haloalkoxy, R.sub.6 is hydrogen, C.sub.1 -C.sub.3 alkyl or C.sub.1 -C.sub.3 alkoxy, X is oxygen or sulfur, and E is nitrogen or the methine group, and R.sub.7 is C.sub.1 -C.sub.4 alkyl which is substituted by halogen or C.sub.1 -C.sub.3 alkoxy or is C.sub.3 -C.sub.5 alkenyl, R.sub.8 is C.sub.1 -C.sub.4 alkyl, C.sub.1 -C.sub.4 haloalkyl or C.sub.2 -C.sub.6 alkoxyalkyl, R.sub.9, R.sub.10, R.sub.11, R.sub.12, R.sub.13 and R.sub.14, each independently of the other, are hydrogen or C.sub.1 -C.sub.3 alkyl, Q is oxygen, sulfur, the sulfinyl or sulfonyl bridge, Y is oxygen, sulfur or --NR.sub.16 --, wherein R.sub.16 is hydrogen or C.sub.1 -C.sub.3 alkyl, Z is oxygen, sulfur or --NR.sub.17 --, wherein R.sub.17 is hydrogen or C.sub.1 -C.sub.3 alkyl, m and n are each 0 to 1, and p is 0, 1 or 2, and to the salts of these compounds with amines, alkali metal bases or alkaline earth metal bases. These compounds have good pre- and postemergence selective herbicidal and growth regulating properties.

  本发明涉及一般式为##STR1##的N-苯磺酰-N'-嘧啶基脲和N-苯磺酰-N-三嗪基脲，其中R.sub.1为氢、卤素、硝基、氨基、C.sub.1-C.sub.5烷基、C.sub.1-C.sub.4卤代烷基或--Q--R.sub.7，--CO--OR.sub.8或--(CO).sub.n--NR.sub.9R.sub.10基团，R.sub.2为氢、C.sub.1-C.sub.4烷基、C.sub.1-C.sub.4烷氧基、C.sub.1-C.sub.4烷硫基、C.sub.1-C.sub.4卤代烷基、C.sub.1-C.sub.4卤代烷氧基、卤素或不超过4个碳原子的烷氧基烷基，R.sub.3为C.sub.2-C.sub.10烯烃，其被一个或多个氟或溴原子或一个或多个羟基，氰基，硝基，--(Y).sub.m--CO--(Z).sub.n--R.sub.8，--SO.sub.2--NR.sub.11R.sub.12，--S(O).sub.p--C.sub.1-C.sub.3卤代烷基或--S(O).sub.n--C.sub.1-C.sub.3烷基基团取代，还可以被一个或多个氯原子取代，R.sub.4为C.sub.1-C.sub.3烷基，C.sub.1-C.sub.3卤代烷基，C.sub.1-C.sub.3烷氧基或C.sub.1-C.sub.3卤代烷氧基，R.sub.5为氢、卤素，--NR.sub.13R.sub.14，C.sub.1-C.sub.3烷基，C.sub.1-C.sub.3卤代烷基，C.sub.1-C.sub.3烷氧基或C.sub.1-C.sub.2卤代烷氧基，R.sub.6为氢，C.sub.1-C.sub.3烷基或C.sub.1-C.sub.3烷氧基，X为氧或硫，E为氮或甲基，R.sub.7为C.sub.1-C.sub.4烷基，其被卤素或C.sub.1-C.sub.3烷氧基取代或为C.sub.3-C.sub.5烯烃，R.sub.8为C.sub.1-C.sub.4烷基，C.sub.1-C.sub.4卤代烷基或C.sub.2-C.sub.6烷氧基烷基，R.sub.9，R.sub.10，R.sub.11，R.sub.12，R.sub.13和R.sub.14，各自独立地为氢或C.sub.1-C.sub.3烷基，Q为氧，硫，亚砜基或磺酰基桥，Y为氧，硫或--NR.sub.16--，其中R.sub.16为氢或C.sub.1-C.sub.3烷基，Z为氧，硫或--NR.sub.17--，其中R.sub.17为氢或C.sub.1-C.sub.3烷基，m和n均为0至1，p为0、1或2，以及这些化合物与胺，碱金属基或碱土金属基的盐。这些化合物具有良好的前和后除草和生长调节特性。
• N-phenylsulfonyl-N'-pyrimidinyl-ureas and N-phenyl-sulfonyl-N'-triazinyl
  申请人：Ciba-Geigy Corporation

  公开号：US05041603A1

  公开（公告）日：1991-08-20

  The invention relates to N-phenylsulfonyl-N'-pyrimidinylureas and N-phenylsulfonyl-N-triazinylureas of the general formula ##STR1## wherein R.sub.1 is hydrogen, halogen, nitro, amino, C.sub.1 -C.sub.5 alkyl, C.sub.1 -C.sub.4 haloalkyl or a --Q--R.sub.7, --CO--OR.sub.8 or --(CO).sub.n --NR.sub.9 R.sub.10 radical, R.sub.2 is hydrogen, C.sub.1 -C.sub.4 alkyl, C.sub.1 -C.sub.4 alkoxy, C.sub.1 -C.sub.4 alkylthio, C.sub.1 -C.sub.4 haloalkyl, C.sub.1 -C.sub.4 haloalkoxy, halogen or alkoxyalkyl containing not more than 4 carbon atoms, R.sub.3 is C.sub.2 -C.sub.10 alkenyl which is substituted by one or more fluorine or bromine atoms or by one or more hydroxyl, cyano, nitro, --(Y).sub.m --CO--(Z).sub.n --R.sub.8, --SO.sub.2 --NR.sub.11 R.sub.12, --S(O).sub.p --C.sub.1 -C.sub.3 haloalkyl or --S(O).sub.n --C.sub.1 -C.sub.3 alkyl groups and which may additionally be substituted by one or more chlorine atoms, R.sub.4 is C.sub.1 -C.sub.3 alkyl, C.sub.1 -C.sub.3 haloalkyl, C.sub.1 -C.sub.3 alkoxy or C.sub.1 -C.sub.3 haloalkoxy, R.sub.5 is hydrogen, halogen, --NR.sub.13 R.sub.14, C.sub.1 -C.sub.3 alkyl, C.sub.1 -C.sub.3 haloalkyl, C.sub.1 -C.sub.3 alkoxy or C.sub.1 -C.sub.2 haloalkoxy, R.sub.6 is hydrogen, C.sub.1 -C.sub.3 alkyl or C.sub.1 -C.sub.3 alkoxy, X is oxygen or sulfur, and E is nitrogen or the methine group, and R.sub.7 is C.sub.1 -C.sub.4 alkyl which is substituted by halogen or C.sub.1 -C.sub.3 alkoxy or is C.sub.3 -C.sub.5 alkenyl, R.sub.8 is C.sub.1 -C.sub.4 alkyl, C.sub.1 -C.sub.4 haloalkyl or C.sub.2 -C.sub.6 alkoxyalkyl, R.sub.9, R.sub.10, R.sub.11, R.sub.12, R.sub.13 and R.sub.14, each independently of the other, are hydrogen or C.sub.1 -C.sub.3 alkyl, Q is oxygen, sulfur, the sulfinyl or sulfonyl bridge, Y is oxygen, sulfur or --NR.sub.16 --, wherein R.sub.16 is hydrogen or C.sub.1 -C.sub.3 alkyl, Z is oxygen, sulfur or --NR.sub.17 --, wherein R.sub.17 is hydrogen or C.sub.1 -C.sub.3 alkyl, m and n are each 0 or 1, and p is 0, 1 or 2, and to the salts of these compounds with amines, alkali metal bases or alkaline earth metal bases. These compounds have good pre- and postemergence selective herbicidal and growth regulating properties.

  本发明涉及一般式为##STR1##的N-苯磺酰-N'-嘧啶脲和N-苯磺酰-N-三嗪脲，其中R.sub.1为氢、卤素、硝基、氨基、C.sub.1-C.sub.5烷基、C.sub.1-C.sub.4卤代烷基或--Q--R.sub.7、--CO--OR.sub.8或--(CO).sub.n--NR.sub.9R.sub.10基团，R.sub.2为氢、C.sub.1-C.sub.4烷基、C.sub.1-C.sub.4烷氧基、C.sub.1-C.sub.4烷硫基、C.sub.1-C.sub.4卤代烷基、C.sub.1-C.sub.4卤代烷氧基、卤素或不含超过4个碳原子的烷氧基烷基，R.sub.3为C.sub.2-C.sub.10烯基，其被一个或多个氟或溴原子或一个或多个羟基、氰基、硝基、--(Y).sub.m--CO--(Z).sub.n--R.sub.8、--SO.sub.2--NR.sub.11R.sub.12、--S(O).sub.p--C.sub.1-C.sub.3卤代烷基或--S(O).sub.n--C.sub.1-C.sub.3烷基基团取代，并且还可以被一个或多个氯原子取代，R.sub.4为C.sub.1-C.sub.3烷基、C.sub.1-C.sub.3卤代烷基、C.sub.1-C.sub.3烷氧基或C.sub.1-C.sub.3卤代烷氧基，R.sub.5为氢、卤素、--NR.sub.13R.sub.14、C.sub.1-C.sub.3烷基、C.sub.1-C.sub.3卤代烷基、C.sub.1-C.sub.3烷氧基或C.sub.1-C.sub.2卤代烷氧基，R.sub.6为氢、C.sub.1-C.sub.3烷基或C.sub.1-C.sub.3烷氧基，X为氧或硫，E为氮或甲基，R.sub.7为C.sub.1-C.sub.4烷基，其被卤素或C.sub.1-C.sub.3烷氧基取代或为C.sub.3-C.sub.5烯基，R.sub.8为C.sub.1-C.sub.4烷基、C.sub.1-C.sub.4卤代烷基或C.sub.2-C.sub.6烷氧基烷基，R.sub.9、R.sub.10、R.sub.11、R.sub.12、R.sub.13和R.sub.14各自独立地为氢或C.sub.1-C.sub.3烷基，Q为氧、硫、亚砜或磺酰桥，Y为氧、硫或--NR.sub.16--，其中R.sub.16为氢或C.sub.1-C.sub.3烷基，Z为氧、硫或--NR.sub.17--，其中R.sub.17为氢或C.sub.1-C.sub.3烷基，m和n各自为0或1，p为0、1或2，并且这些化合物与胺、碱金属基或碱土金属基的盐具有良好的前和后除草和生长调节特性。