HRID91864

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

HCID166653

Hydride

H-

HCID236969

4-(chloromethyl)-2-phenyl-1,3-thiazole

C10H8ClNS

结构：CCOC(=O)CCc1cn(Cc2ccc(O)cc2)cc1-c1ccccc1

HCID23024736

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CCc1cn(Cc2ccc(OCc3csc(-c4ccccc4)n3)cc2)cc1-c1ccccc1

HCID23025039

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5ae9a5230ff34fbc845a11a82fae7a1f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[Cl:29][CH2:30][c:31]1[n:32][c:33](-[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[s:34][cH:35]1.[H-:1].[Na+:2].[OH2:42].[OH:3][c:4]1[cH:5][cH:6][c:7]([CH2:8][n:9]2[cH:10][c:11]([CH2:20][CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[c:12](-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[cH:13]2)[cH:27][cH:28]1>>[O:3]([c:4]1[cH:5][cH:6][c:7]([CH2:8][n:9]2[cH:10][c:11]([CH2:20][CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[c:12](-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[cH:13]2)[cH:27][cH:28]1)[CH2:30][c:31]1[n:32][c:33](-[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[s:34][cH:35]1