HRID2389689

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2773420

[4-(Ethanesulfonyl)phenyl]boronic acid

C8H11BO4S

结构：COc1ccc(Br)cc1CN(C(=O)c1sc2c(F)ccc(F)c2c1Cl)C1CCC(N(C)C(=O)OC(C)(C)C)CC1

HCID59683556

未命名化合物

PRODUCTS

生成物

结构：CCS(=O)(=O)c1ccc(-c2ccc(OC)c(CN(C(=O)c3sc4c(F)ccc(F)c4c3Cl)C3CCC(N(C)C(=O)OC(C)(C)C)CC3)c2)cc1

HCID59683486

未命名化合物

PROCEDURE

实验过程

Aryl bromide 220 (200 mg, 0.30 mmol) is coupled to 4-(ethanesulfonyl)-benzene boronic acid (65 mg, 0.30 mmol) using Method A to afford the title compound.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cc16122cbffd402f9d6795b4c693b465
来源数据集: uspto-grants-2012_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08273747B2
来源说明: uspto-grants-2012_09

反应 SMILES

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