HRID159260

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID674

Dimethylamine

C2H7N

HCID887

Methanol

CH4O

HCID23938

Palladium

结构：CCOC(=O)c1cccc(C#Cc2cccc(-c3c4cccc(C(F)(F)F)c4nn3Cc3c(F)cc(F)cc3F)c2)c1

HCID86603014

未命名化合物

PRODUCTS

生成物

HCID86603015

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-96badd0c08e6424a8f752b583583f8f2
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

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