HRID682189

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID28179

Fluoride

F-

HCID31275

1,4-Dioxane

C4H8O2

HCID104967

Cesium(1+)

Cs+

HCID105144

Palladium(2+)

Pd+2

HCID642851

Diethyl(3-pyridyl)borane

C9H14BN

结构：CCCC(=O)Nc1nn(COCC[Si](C)(C)C)c2cc(Cl)ccc12

HCID10406687

N-[6-chloro-1-[[2-(trimethylsilyl)ethoxy)methyl]-1H-indazol-3-yl)butanamide

C17H26ClN3O2Si

PRODUCTS

生成物

结构：CCCC(=O)Nc1nn(COCC[Si](C)(C)C)c2cc(-c3cccnc3)ccc12

HCID10386888

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-63fbc7e9dd68408b8984a93d8873dde0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:44]([O-:45])(=[O:46])[CH3:47].[C:49]([O-:50])(=[O:51])[CH3:52].[CH2:1]([B:2]([CH2:3][CH3:10])[c:4]1[cH:5][n:6][cH:7][cH:8][cH:9]1)[CH3:11].[Cl:14][c:15]1[cH:16][cH:17][c:18]2[c:19]([NH:32][C:33]([CH2:34][CH2:35][CH3:36])=[O:37])[n:20][n:21]([CH2:24][O:25][CH2:26][CH2:27][Si:28]([CH3:29])([CH3:30])[CH3:31])[c:22]2[cH:23]1.[Cs+:13].[F-:12].[O:38]1[CH2:39][CH2:40][O:41][CH2:42][CH2:43]1.[Pd+2:48]>>[c:4]1(-[c:15]2[cH:16][cH:17][c:18]3[c:19]([NH:32][C:33]([CH2:34][CH2:35][CH3:36])=[O:37])[n:20][n:21]([CH2:24][O:25][CH2:26][CH2:27][Si:28]([CH3:29])([CH3:30])[CH3:31])[c:22]3[cH:23]2)[cH:5][n:6][cH:7][cH:8][cH:9]1