HRID140092

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID26255

Tetrafluoroborate

BF4-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID4719439

N-(2-chlorobenzyl)-N-ethylamine

C9H12ClN

HCID57640312

未命名化合物

PRODUCTS

生成物

结构：CCN(Cc1ccccc1Cl)C(=O)COc1ccc(CCSc2ccccc2C(=O)OC)cc1

HCID69259897

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-220ec3cfa3d847da8bb56732a47c6294
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

[B-:36]([F:37])([F:38])([F:39])[F:40].[CH2:58]([N:59]([CH:60]([CH3:61])[CH3:62])[CH:63]([CH3:64])[CH3:65])[CH3:66].[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([S:11][CH2:12][CH2:13][c:14]2[cH:15][cH:16][c:17]([O:18][CH2:19][C:20](=[O:21])[OH:22])[cH:23][cH:24]2)[cH:7][cH:8][cH:9][cH:10]1.[Cl:25][c:26]1[c:27]([CH2:28][NH:29][CH2:30][CH3:31])[cH:32][cH:33][cH:34][cH:35]1.[Cl:67][CH2:68][Cl:69].[n:41]1([O:42][C:43]([N:44]([CH3:45])[CH3:46])=[N+:47]([CH3:48])[CH3:49])[c:50]2[cH:51][cH:52][cH:53][cH:54][c:55]2[n:56][n:57]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([S:11][CH2:12][CH2:13][c:14]2[cH:15][cH:16][c:17]([O:18][CH2:19][C:20](=[O:22])[N:29]([CH2:28][c:27]3[c:26]([Cl:25])[cH:35][cH:34][cH:33][cH:32]3)[CH2:30][CH3:31])[cH:23][cH:24]2)[cH:7][cH:8][cH:9][cH:10]1