HRID403667

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC1(C)OB(c2ccc3c(c2)CC=C3CNS(C)(=O)=O)OC1(C)C

HCID57493915

未命名化合物

结构：COc1c(Br)cc(-c2cnc(OC(C)(C)C)nc2OC(C)(C)C)cc1C(C)(C)C

HCID66833848

未命名化合物

PRODUCTS

生成物

结构：COc1c(-c2ccc3c(c2)CC=C3CNS(C)(=O)=O)cc(-c2cnc(OC(C)(C)C)nc2OC(C)(C)C)cc1C(C)(C)C

HCID66833976

未命名化合物

PROCEDURE

实验过程

The product from Example 2 Part A (55.9 mg, 0.12 mmol) and N-((6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-inden-3-yl)methyl)methanesulfonamide (41.9 mg, 0.120 mmol) were reacted in the same manner as Example 2 Part B. The crude product was purified by silica gel flash chromatography eluting with ethyl acetate/hexane (5% to 25%) to give the title compound.

WORKUP

后处理

customThe crude product was purified by silica gel flash chromatography
washeluting with ethyl acetate/hexane (5% to 25%)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8f745a5f5f644bba9f139ebbca74f625
来源数据集: uspto-grants-2014_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08748443B2
来源说明: uspto-grants-2014_06

反应 SMILES

Br[C:2]1[CH:3]=[C:4]([C:14]2[C:15]([O:25][C:26]([CH3:29])([CH3:28])[CH3:27])=[N:16][C:17]([O:20][C:21]([CH3:24])([CH3:23])[CH3:22])=[N:18][CH:19]=2)[CH:5]=[C:6]([C:10]([CH3:13])([CH3:12])[CH3:11])[C:7]=1[O:8][CH3:9].CC1(C)C(C)(C)OB([C:38]2[CH:46]=[C:45]3[C:41]([C:42]([CH2:47][NH:48][S:49]([CH3:52])(=[O:51])=[O:50])=[CH:43][CH2:44]3)=[CH:40][CH:39]=2)O1>>[C:10]([C:6]1[C:7]([O:8][CH3:9])=[C:2]([C:38]2[CH:46]=[C:45]3[C:41]([C:42]([CH2:47][NH:48][S:49]([CH3:52])(=[O:50])=[O:51])=[CH:43][CH2:44]3)=[CH:40][CH:39]=2)[CH:3]=[C:4]([C:14]2[C:15]([O:25][C:26]([CH3:27])([CH3:28])[CH3:29])=[N:16][C:17]([O:20][C:21]([CH3:23])([CH3:24])[CH3:22])=[N:18][CH:19]=2)[CH:5]=1)([CH3:12])([CH3:11])[CH3:13]