HRID112691

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID260

Hydrogen Bromide

BrH

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID16028

Tetrabutylammonium

C16H36N+

HCID30165

Iodide ion

I-

HCID166653

Hydride

H-

HCID245934

3-(Bromomethyl)pyridine

C6H6BrN

结构：Cc1nc(-n2ccc(O)cc2=O)sc1C(=O)NCc1ccccc1

HCID54742338

N-Benzyl-2-(4-hydroxy-2-oxo-1(2H)-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide

C17H15N3O3S

PRODUCTS

生成物

结构：Cc1nc(-n2ccc(OCc3cccnc3)cc2=O)sc1C(=O)NCc1ccccc1

HCID24985612

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-032fbf9dca164801ae65681facf89df4
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

[Br:28][CH2:29][c:30]1[cH:31][n:32][cH:33][cH:34][cH:35]1.[BrH:27].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[c:11]1[c:12]([CH3:24])[n:13][c:14](-[n:16]2[c:17](=[O:23])[cH:18][c:19]([OH:22])[cH:20][cH:21]2)[s:15]1.[CH2:42]([N+:43]([CH2:44][CH2:45][CH2:46][CH3:47])([CH2:48][CH2:49][CH2:50][CH3:51])[CH2:52][CH2:53][CH2:54][CH3:55])[CH2:56][CH2:57][CH3:58].[CH3:36][N:37]([CH3:38])[CH:39]=[O:40].[H-:25].[I-:41].[Na+:26]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[c:11]1[c:12]([CH3:24])[n:13][c:14](-[n:16]2[c:17](=[O:23])[cH:18][c:19]([O:22][CH2:29][c:30]3[cH:31][n:32][cH:33][cH:34][cH:35]3)[cH:20][cH:21]2)[s:15]1