HRID2344690

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID795

Imidazole

C3H4N2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID28928

Chloro(1,1-dimethylethyl)dimethylsilane

C6H15ClSi

结构：NC(=O)c1ccc(Br)c2c1[nH]c1cc(C3(O)CC3)ccc12

HCID66606056

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)[Si](C)(C)OC1(c2ccc3c(c2)[nH]c2c(C(N)=O)ccc(Br)c23)CC1

HCID66605637

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-477e2f54304144768ed6216bcba67eb1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[Br:1][c:2]1[cH:3][cH:4][c:5]([C:19](=[O:20])[NH2:21])[c:6]2[nH:7][c:8]3[cH:9][c:10]([C:15]4([OH:18])[CH2:16][CH2:17]4)[cH:11][cH:12][c:13]3[c:14]12.[C:22]([CH3:23])([CH3:24])([CH3:25])[Si:26]([CH3:27])([CH3:28])[Cl:29].[CH3:40][CH2:41][O:42][C:43]([CH3:44])=[O:45].[O:35]=[CH:36][N:37]([CH3:38])[CH3:39].[nH:30]1[cH:31][cH:32][n:33][cH:34]1>>[Br:1][c:2]1[cH:3][cH:4][c:5]([C:19](=[O:20])[NH2:21])[c:6]2[nH:7][c:8]3[cH:9][c:10]([C:15]4([O:18][Si:26]([C:22]([CH3:23])([CH3:24])[CH3:25])([CH3:27])[CH3:28])[CH2:16][CH2:17]4)[cH:11][cH:12][c:13]3[c:14]12