HRID304585

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID12703

N,N-Diethylacetamide

C6H13NO

HCID16988

2,3-Dichloropyridine

C5H3Cl2N

HCID31275

1,4-Dioxane

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

结构：COCc1nc2c(c(Nc3ccc(C(F)(F)F)cc3)n1)CCNC2

HCID59021578

未命名化合物

PRODUCTS

生成物

结构：COCc1nc2c(c(Nc3ccc(C(F)(F)F)cc3)n1)CCN(c1ncccc1Cl)C2

HCID59021463

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0fe2dffde69645b5b29b22cf7e263f6f
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

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