HRID1144110

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID69993

4-Methyloxybenzyl chloride

C8H9ClO

HCID166653

Hydride

H-

HCID66682656

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2ccc(Cl)cn2)cc1

HCID66683387

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8393ba98266f47bd86124bc7690f591a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:23][O:24][c:25]1[cH:26][cH:27][c:28]([CH2:29][Cl:30])[cH:31][cH:32]1.[CH3:34][N:35]([CH3:36])[CH:37]=[O:38].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH2:12][c:13]2[cH:14][cH:15][c:16]([O:19][CH3:20])[cH:17][cH:18]2)[n:6][cH:7]1.[H-:21].[Na+:22].[OH2:33]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH2:12][c:13]2[cH:14][cH:15][c:16]([O:19][CH3:20])[cH:17][cH:18]2)[CH2:29][c:28]2[cH:27][cH:26][c:25]([O:24][CH3:23])[cH:32][cH:31]2)[n:6][cH:7]1