HRID112234

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID75555

未命名化合物

HCID13111845

未命名化合物

HCID46833094

1-(2-Fluorophenyl)-1,3-dihydro-2H-2lambda~6~,1,3-benzothiadiazole-2,2-dione

C12H9FN2O2S

PRODUCTS

生成物

结构：CC(CCBr)N1c2ccccc2N(c2ccccc2F)S1(=O)=O

HCID68709828

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8633098340c94b88810fb1d412049d28
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:38][CH2:39][CH2:40][CH:41]([CH3:42])[OH:43].[F:1][c:2]1[c:3]([N:8]2[S:9](=[O:17])(=[O:18])[NH:10][c:11]3[c:12]2[cH:13][cH:14][cH:15][cH:16]3)[cH:4][cH:5][cH:6][cH:7]1.[O:44]=[C:45]([O:46][CH:47]([CH3:48])[CH3:49])[N:50]=[N:51][C:52]([O:53][CH:54]([CH3:55])[CH3:56])=[O:57].[O:58]1[CH2:59][CH2:60][CH2:61][CH2:62]1.[c:19]1([P:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[F:1][c:2]1[c:3]([N:8]2[S:9](=[O:17])(=[O:18])[N:10]([CH:41]([CH2:40][CH2:39][Br:38])[CH3:42])[c:11]3[c:12]2[cH:13][cH:14][cH:15][cH:16]3)[cH:4][cH:5][cH:6][cH:7]1