HRID103724

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7912

Diisopropylamine

C6H15N

HCID2734355

2-Formylfuran-5-boronic acid

C5H5BO4

结构：CC(NC(=O)c1cc(Br)cc(N(C)S(C)(=O)=O)c1)c1ccc(F)cc1

HCID72482948

未命名化合物

PRODUCTS

生成物

结构：CC(NC(=O)c1cc(-c2ccc(C=O)o2)cc(N(C)S(C)(=O)=O)c1)c1ccc(F)cc1

HCID72483004

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-be73a85121b2466ab64f4432f0c58f1c
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:5](=[O:6])[NH:7][CH:8]([CH3:9])[c:10]2[cH:11][cH:12][c:13]([F:16])[cH:14][cH:15]2)[cH:17][c:18]([N:20]([S:21](=[O:22])(=[O:23])[CH3:24])[CH3:25])[cH:19]1.[CH:26](=[O:27])[c:28]1[cH:29][cH:30][c:31]([B:33]([OH:34])[OH:35])[o:32]1.[CH:36]([NH:37][CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47]>>[c:2]1(-[c:31]2[cH:30][cH:29][c:28]([CH:26]=[O:27])[o:32]2)[cH:3][c:4]([C:5](=[O:6])[NH:7][CH:8]([CH3:9])[c:10]2[cH:11][cH:12][c:13]([F:16])[cH:14][cH:15]2)[cH:17][c:18]([N:20]([S:21](=[O:22])(=[O:23])[CH3:24])[CH3:25])[cH:19]1