HRID96871

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID176

Acetic Acid

C2H4O2

HCID6344

Dichloromethane

CH2Cl2

结构：CC(C)(C)OC(=O)N1CC(O[Si](C)(C)C(C)(C)C)CC1C=O

HCID14863943

未命名化合物

HCID58243054

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(Oc2nc(Cl)ncc2NCC2CC(O[Si](C)(C)C(C)(C)C)CN2C(=O)OC(C)(C)C)cc1

HCID87305967

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-474af3b35e964390bc5497c3844afc8b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:18]([CH3:19])([CH3:20])([CH3:21])[O:22][C:23](=[O:24])[N:25]1[CH:26]([CH:38]=[O:39])[CH2:27][CH:28]([O:30][Si:31]([CH3:32])([CH3:33])[C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:29]1.[CH3:40][C:41](=[O:42])[OH:43].[Cl:1][c:2]1[n:3][cH:4][c:5]([NH2:17])[c:6]([O:8][c:9]2[cH:10][cH:11][c:12]([O:15][CH3:16])[cH:13][cH:14]2)[n:7]1.[Cl:44][CH2:45][CH2:46][Cl:47].[Cl:48][CH2:49][Cl:50]>>[Cl:1][c:2]1[n:3][cH:4][c:5]([NH:17][CH2:38][CH:26]2[N:25]([C:23]([O:22][C:18]([CH3:19])([CH3:20])[CH3:21])=[O:24])[CH2:29][CH:28]([O:30][Si:31]([CH3:32])([CH3:33])[C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:27]2)[c:6]([O:8][c:9]2[cH:10][cH:11][c:12]([O:15][CH3:16])[cH:13][cH:14]2)[n:7]1