HRID166441

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID139909

2-Chloro-4-fluorobenzylamine

C7H7ClFN

HCID4154053

未命名化合物

PRODUCTS

生成物

HCID20968164

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7094a6ade2c74bee91d368c2165b481f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH3:1][CH:2]([CH3:3])[N:4]1[CH:5]([C:6](=[O:7])[OH:8])[CH2:9][CH2:10][C:11]1=[O:12].[CH3:34][N:35]([CH3:36])[CH2:37][CH2:38][CH2:39][N:40]=[C:41]=[N:42][CH2:43][CH3:44].[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[Cl:23][c:24]1[c:25]([CH2:31][NH2:32])[cH:26][cH:27][c:28]([F:30])[cH:29]1.[Cl:45][CH2:46][Cl:47].[ClH:33].[OH:13][n:14]1[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]2[n:21][n:22]1>>[CH3:1][CH:2]([CH3:3])[N:4]1[CH:5]([C:6](=[O:8])[NH:32][CH2:31][c:25]2[c:24]([Cl:23])[cH:29][c:28]([F:30])[cH:27][cH:26]2)[CH2:9][CH2:10][C:11]1=[O:12]