HRID1096862

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2773564

3-Chloro-2,6-difluorophenol

C6H3ClF2O

结构：CC(C)(C)OC(=O)N1CC2CC(c3nc(CCCO)cs3)=C(C(=O)N(Cc3cccc(Cl)c3Cl)C3CC3)C(C1)N2C(=O)OC(C)(C)C

HCID68570774

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CC2CC(c3nc(CCCOc4c(F)ccc(Cl)c4F)cs3)=C(C(=O)N(Cc3cccc(Cl)c3Cl)C3CC3)C(C1)N2C(=O)OC(C)(C)C

HCID68570967

未命名化合物

PROCEDURE

实验过程

This compound is prepared from compound E4 and 3-chloro-2,6-difluorophenol, according to the above-described procedure A.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8bd0f24c9805413eb64f4fb69ef550e0
来源数据集: uspto-grants-2012_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08138340B2
来源说明: uspto-grants-2012_03

反应 SMILES

[C:1]([O:5][C:6]([N:8]1[CH2:15][CH:14]2[N:16]([C:17]([O:19][C:20]([CH3:23])([CH3:22])[CH3:21])=[O:18])[CH:10]([CH2:11][C:12]([C:39]3[S:40][CH:41]=[C:42]([CH2:44][CH2:45][CH2:46][OH:47])[N:43]=3)=[C:13]2[C:24](=[O:38])[N:25]([CH:35]2[CH2:37][CH2:36]2)[CH2:26][C:27]2[CH:32]=[CH:31][CH:30]=[C:29]([Cl:33])[C:28]=2[Cl:34])[CH2:9]1)=[O:7])([CH3:4])([CH3:3])[CH3:2].[Cl:48][C:49]1[C:50]([F:57])=[C:51](O)[C:52]([F:55])=[CH:53][CH:54]=1>>[C:1]([O:5][C:6]([N:8]1[CH2:15][CH:14]2[N:16]([C:17]([O:19][C:20]([CH3:23])([CH3:22])[CH3:21])=[O:18])[CH:10]([CH2:11][C:12]([C:39]3[S:40][CH:41]=[C:42]([CH2:44][CH2:45][CH2:46][O:47][C:51]4[C:52]([F:55])=[CH:53][CH:54]=[C:49]([Cl:48])[C:50]=4[F:57])[N:43]=3)=[C:13]2[C:24](=[O:38])[N:25]([CH:35]2[CH2:36][CH2:37]2)[CH2:26][C:27]2[CH:32]=[CH:31][CH:30]=[C:29]([Cl:33])[C:28]=2[Cl:34])[CH2:9]1)=[O:7])([CH3:4])([CH3:2])[CH3:3]