HRID210121

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CN(C)CCNC(=O)c1ccc(B2OC(C)(C)C(C)(C)O2)cc1

HCID2758503

N-[2-(Dimethylamino)ethyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide

C17H27BN2O3

HCID57886093

未命名化合物

PRODUCTS

生成物

结构：CN(C)CCNC(=O)c1ccc(-c2cnc3c(c2)N(C(=O)c2ccccc2)CCN3)cc1

HCID24853013

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ed30163f34214357b3c212d6e8648396
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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