HRID159008

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2734620

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)aniline

C12H18BNO2

结构：CNC(=O)Nc1ccc(-c2nc(Cl)nc(N3C(C)COCC3C)n2)cc1

HCID86636524

1-(4-(4-Chloro-6-(3,5-dimethylmorpholino)-1,3,5-triazin-2-yl)phenyl)-3-methylurea

C17H21ClN6O2

PRODUCTS

生成物

结构：CNC(=O)Nc1ccc(-c2nc(-c3ccc(N)cc3)nc(N3C(C)COCC3C)n2)cc1

HCID67438018

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f46284f38f644a17a0b7e46df2045503
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

[CH3:27][C:28]1([CH3:29])[C:30]([CH3:31])([CH3:32])[O:33][B:34]([c:35]2[cH:36][cH:37][c:38]([NH2:39])[cH:40][cH:41]2)[O:42]1.[Cl:1][c:2]1[n:3][c:4](-[c:16]2[cH:17][cH:18][c:19]([NH:22][C:23](=[O:24])[NH:25][CH3:26])[cH:20][cH:21]2)[n:5][c:6]([N:8]2[CH:9]([CH3:15])[CH2:10][O:11][CH2:12][CH:13]2[CH3:14])[n:7]1>>[c:2]1(-[c:35]2[cH:36][cH:37][c:38]([NH2:39])[cH:40][cH:41]2)[n:3][c:4](-[c:16]2[cH:17][cH:18][c:19]([NH:22][C:23](=[O:24])[NH:25][CH3:26])[cH:20][cH:21]2)[n:5][c:6]([N:8]2[CH:9]([CH3:15])[CH2:10][O:11][CH2:12][CH:13]2[CH3:14])[n:7]1