HRID291907

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID312718

1-(3-Isocyanatophenyl)ethan-1-one

C9H7NO2

HCID59240283

未命名化合物

PRODUCTS

生成物

结构：CC(=O)c1cccc(NC(=O)Nc2cc(C(F)(F)F)nn2-c2ccccc2C(F)(F)F)c1

HCID59240182

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9d43d0b930144403a852f582ed5dfa2d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH:21]([N:22]([CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])([CH3:28])[CH3:29].[Cl:42][CH2:43][Cl:44].[F:1][C:2]([c:3]1[cH:4][c:5]([NH2:18])[n:6](-[c:8]2[c:9]([C:14]([F:15])([F:16])[F:17])[cH:10][cH:11][cH:12][cH:13]2)[n:7]1)([F:19])[F:20].[N:30](=[C:31]=[O:32])[c:33]1[cH:34][c:35]([C:39]([CH3:40])=[O:41])[cH:36][cH:37][cH:38]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([NH:18][C:31]([NH:30][c:33]2[cH:34][c:35]([C:39]([CH3:40])=[O:41])[cH:36][cH:37][cH:38]2)=[O:32])[n:6](-[c:8]2[c:9]([C:14]([F:15])([F:16])[F:17])[cH:10][cH:11][cH:12][cH:13]2)[n:7]1)([F:19])[F:20]