HRID140667

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7398

Benzenesulfonyl chloride, 4-chloro-

C6H4Cl2O2S

HCID7937

2,6-Dimethylpyridine

C7H9N

结构：COC(=O)Cc1ccc(Oc2cc3c(cc2N)C(=O)NC3=O)c(Cl)c1

HCID59864779

Methyl 2-(4-(6-amino-1,3-dioxoisoindolin-5-yloxy)-3-chlorophenyl)acetate

C17H13ClN2O5

PRODUCTS

生成物

结构：COC(=O)Cc1ccc(Oc2cc3c(cc2NS(=O)(=O)c2ccc(Cl)cc2)C(=O)NC3=O)c(Cl)c1

HCID67244284

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-86fa8d7ff9c0437c80855c364d60d6dc
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

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