HRID112884

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID13333560

5-Bromofuran-3-carboxylic acid

C5H3BrO3

结构：NC(Cc1ccccc1C(F)(F)F)CN1C(=O)c2ccccc2C1=O

HCID178510762

未命名化合物

PRODUCTS

生成物

结构：O=C(NC(Cc1ccccc1C(F)(F)F)CN1C(=O)c2ccccc2C1=O)c1coc(Br)c1

HCID77220065

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d31d7115fa7c40d6a6191caafda89b61
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]([C:7](=[O:8])[OH:9])[cH:5][o:6]1.[CH:35]([N:36]([CH:37]([CH3:38])[CH3:39])[CH2:40][CH3:41])([CH3:42])[CH3:43].[Cl:44][CH2:45][Cl:46].[NH2:10][CH:11]([CH2:12][N:13]1[C:14](=[O:23])[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]2[C:21]1=[O:22])[CH2:24][c:25]1[c:26]([C:31]([F:32])([F:33])[F:34])[cH:27][cH:28][cH:29][cH:30]1>>[Br:1][c:2]1[cH:3][c:4]([C:7](=[O:9])[NH:10][CH:11]([CH2:12][N:13]2[C:14](=[O:23])[c:15]3[cH:16][cH:17][cH:18][cH:19][c:20]3[C:21]2=[O:22])[CH2:24][c:25]2[c:26]([C:31]([F:32])([F:33])[F:34])[cH:27][cH:28][cH:29][cH:30]2)[cH:5][o:6]1