HRID2151242

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID53408009

4-Iodo-1-methylpyridin-2(1H)-one

C6H6INO

结构：C=C(C)CC1(c2ccccc2)CCCN(C(C)c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)C(=O)N1

HCID178440553

未命名化合物

PRODUCTS

生成物

结构：C=C(C)CC1(c2ccccc2)CCCN(C(C)c2ccc(-c3ccn(C)c(=O)c3)cc2)C(=O)N1

HCID178440557

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-65e9690ee1124a4ab33800872e42fbc2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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