HRID142234

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID2737364

5-Fluoro-2-methoxybenzoic acid

C8H7FO3

HCID178486794

未命名化合物

PRODUCTS

生成物

结构：COc1cc2nc(-c3n[nH]cc3NC(=O)c3cc(F)ccc3OC)[nH]c2cc1OC

HCID178486787

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ae61eb7033d64dffb09e6dbaba6dbfc2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:1]([Cl:2])[CH2:3][Cl:4].[CH3:15][O:16][c:17]1[cH:18][c:19]2[c:20]([nH:21][c:22](-[c:24]3[n:25][nH:26][cH:27][c:28]3[NH2:29])[n:23]2)[cH:30][c:31]1[O:32][CH3:33].[F:34][c:35]1[cH:36][cH:37][c:38]([O:44][CH3:45])[c:39]([C:40](=[O:41])[OH:42])[cH:43]1.[O:46]=[CH:47][N:48]([CH3:49])[CH3:50].[OH:5][n:6]1[c:7]2[c:8]([cH:9][cH:10][cH:11][cH:12]2)[n:13][n:14]1>>[CH3:15][O:16][c:17]1[cH:18][c:19]2[c:20]([n:21][c:22](-[c:24]3[n:25][nH:26][cH:27][c:28]3[NH:29][C:40]([c:39]3[c:38]([O:44][CH3:45])[cH:37][cH:36][c:35]([F:34])[cH:43]3)=[O:41])[nH:23]2)[cH:30][c:31]1[O:32][CH3:33]