HRID174364

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl Acetate

C4H8O2

HCID27099

Copper(2+)

Cu+2

HCID2763299

2,2-Dimethylethenylboronic acid

C4H9BO2

HCID135427273

未命名化合物

PRODUCTS

产物

HCID59469496

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-f8714a4a7cea48c7a517412740208d6d
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

[C:56]([O-:57])(=[O:58])[CH3:59].[C:61]([O-:62])(=[O:63])[CH3:64].[CH2:47]([Cl:48])[Cl:49].[CH3:1][c:2]1[nH:3][c:4](=[O:26])[c:5]([CH2:11][c:12]2[cH:13][cH:14][c:15](-[c:18]3[c:19]([C:24]#[N:25])[cH:20][cH:21][cH:22][cH:23]3)[cH:16][cH:17]2)[c:6]([CH2:8][CH2:9][CH3:10])[n:7]1.[CH3:27][C:28](=[CH:29][B:30]([OH:31])[OH:32])[CH3:33].[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[Cu+2:60].[cH:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1>>[CH3:1][c:2]1[n:3]([CH:27]=[C:28]([CH3:29])[CH3:33])[c:4](=[O:26])[c:5]([CH2:11][c:12]2[cH:13][cH:14][c:15](-[c:18]3[c:19]([C:24]#[N:25])[cH:20][cH:21][cH:22][cH:23]3)[cH:16][cH:17]2)[c:6]([CH2:8][CH2:9][CH3:10])[n:7]1