HRID1220191

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7242

2-Methylaniline

C7H9N

结构：O=Cc1cccc(-c2c(C(=O)c3ccccc3)cnc3c(C(F)(F)F)cccc23)c1

HCID86055603

未命名化合物

PRODUCTS

生成物

结构：Cc1ccccc1NCc1cccc(-c2c(C(=O)c3ccccc3)cnc3c(C(F)(F)F)cccc23)c1

HCID66914222

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dad5cd95c37e4c7791307b98a70f3a4b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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