HRID96971

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6212

Chloroform

CHCl3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID735247

5-bromo-1-benzofuran-2-carboxylic acid

C9H5BrO3

HCID12048208

N-CYCLOHEXYLCARBODIIMIDE

C7H12N2

HCID21973458

未命名化合物

PRODUCTS

生成物

结构：CC1CN(C(=O)c2cc3cc(Br)ccc3o2)C(C)CN1Cc1ccc(F)cc1

HCID59676255

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-433e3673f6304e9fb934bf3c616aba9c
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:17][c:18]1[cH:19][cH:20][c:21]2[c:22]([cH:23][c:24]([C:26](=[O:27])[OH:28])[o:25]2)[cH:29]1.[CH:40]1([N:41]=[C:42]=[NH:43])[CH2:44][CH2:45][CH2:46][CH2:47][CH2:48]1.[Cl:49][CH:50]([Cl:51])[Cl:52].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]2[CH:8]([CH3:14])[CH2:9][NH:10][CH:11]([CH3:13])[CH2:12]2)[cH:15][cH:16]1.[OH:30][n:31]1[c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]2[n:38][n:39]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]2[CH:8]([CH3:14])[CH2:9][N:10]([C:26]([c:24]3[cH:23][c:22]4[c:21]([cH:20][cH:19][c:18]([Br:17])[cH:29]4)[o:25]3)=[O:27])[CH:11]([CH3:13])[CH2:12]2)[cH:15][cH:16]1