HRID296122

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID16988

2,3-Dichloropyridine

C5H3Cl2N

HCID31275

1,4-Dioxane

C4H8O2

HCID31374

Dimethylacetamide

C4H9NO

HCID81531

Diisopropylethylamine

C8H19N

HCID59346476

未命名化合物

PRODUCTS

生成物

结构：FC(F)(F)c1ccc(Nc2ncnc3c2CN(c2ncccc2Cl)CC3)cc1

HCID59346488

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3779cf29ee2e49d0b0b94bd232d40f18
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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