HRID702088

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID12986357

未命名化合物

结构：COC(=O)c1sc(C#CC(C)(C)C)cc1NNC(=O)C(F)(F)F

HCID86655594

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1sc(C#CC(C)(C)C)cc1N(NC(=O)C(F)(F)F)C(=O)C1CCC(C)CC1

HCID86655595

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-94d9abeaaa5c4712b4bb3bb7ec0d494a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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