HRID2310432

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID13097

Triphenylphosphine oxide

C18H15OP

HCID83795

1-Acetylpiperazine

C6H12N2O

结构：COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCBr

HCID58960237

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCN1CCN(C(C)=O)CC1

HCID11752254

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-22aa05daf5344c88a1a2ec698d2104cf
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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