HRID554604

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID54116619

Ethyl (5-bromopyridin-3-yl)acetate

C9H10BrNO2

结构：CC(C)(C)NC(=O)c1ccc(B2OC(C)(C)C(C)(C)O2)c(CN(Cc2ccccc2)C(=O)C2CC2)c1

HCID67212685

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)Cc1cncc(-c2ccc(C(=O)NC(C)(C)C)cc2CN(Cc2ccccc2)C(=O)C2CC2)c1

HCID67212635

未命名化合物

PROCEDURE

实验过程

3-[(N-benzyl-N-cyclopropanecarbonyl-amino)-methyl]-N-tert-butyl-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzamide and (5-bromo-pyridin-3-yl)-acetic acid ethyl ester were reacted as described in Example 3, Step 6 to provide (5-{2-[(N-benzyl-N-cyclopropanecarbonyl-amino)-methyl]-4-tert-butylcarbamoyl-phenyl}-pyridin-3-yl)-acetic acid ethyl ester.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d1ade0c250a24544ae347a1cd8809dd1
来源数据集: uspto-grants-2011_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08049015B2
来源说明: uspto-grants-2011_11

反应 SMILES

[CH2:1]([N:8]([CH2:14][C:15]1[CH:16]=[C:17]([CH:25]=[CH:26][C:27]=1B1OC(C)(C)C(C)(C)O1)[C:18]([NH:20][C:21]([CH3:24])([CH3:23])[CH3:22])=[O:19])[C:9]([CH:11]1[CH2:13][CH2:12]1)=[O:10])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.[CH2:37]([O:39][C:40](=[O:49])[CH2:41][C:42]1[CH:43]=[N:44][CH:45]=[C:46](Br)[CH:47]=1)[CH3:38]>>[CH2:37]([O:39][C:40](=[O:49])[CH2:41][C:42]1[CH:43]=[N:44][CH:45]=[C:46]([C:27]2[CH:26]=[CH:25][C:17]([C:18](=[O:19])[NH:20][C:21]([CH3:22])([CH3:23])[CH3:24])=[CH:16][C:15]=2[CH2:14][N:8]([CH2:1][C:2]2[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=2)[C:9]([CH:11]2[CH2:12][CH2:13]2)=[O:10])[CH:47]=1)[CH3:38]