HRID282914

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID10331

2-Benzofurancarboxylic acid

C9H6O3

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

结构：CC(C)C(NS(=O)(=O)c1ccc(-c2ccc(O)cc2)cc1)C(=O)OC(C)(C)C

HCID67109964

未命名化合物

PRODUCTS

生成物

结构：CC(C)C(NS(=O)(=O)c1ccc(-c2ccc(OC(=O)c3cc4ccccc4o3)cc2)cc1)C(=O)OC(C)(C)C

HCID67109825

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e2fd2265f69a42cc9e76a557c5495b38
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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