HRID2127796

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID121724

2-Chloro-6-methylnicotinic acid

C7H6ClNO2

HCID178510680

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(C(=O)NCC2=NN=C(N)C2=NNc2ccc(F)c(F)c2)c(Cl)n1

HCID178425854

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b84521b6d0434154b28fe449454176d6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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