HRID1222911

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

Dimethylformamide

C3H7NO

HCID70128

1-(Chloromethyl)-4-(methylthio)benzene

C8H9ClS

HCID166653

Hydride

H-

结构：CCOC(OCC)c1ccc(CC(C(=O)OC)C(=O)OC)cc1

HCID21265723

未命名化合物

PRODUCTS

生成物

结构：CCOC(OCC)c1ccc(CC(Cc2ccc(SC)cc2)(C(=O)OC)C(=O)OC)cc1

HCID86756239

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b4011452e92a4946bb2fb6fed5685fcd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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