HRID86162

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

HCID619908

未命名化合物

HCID2764081

N-Boc-4-piperidinemethanol

C11H21NO3

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(COc2cnc(-c3ccc(Br)cc3)nc2)CC1

HCID66673116

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dd9ca9b4be574d66804507d9e566bb25
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][cH:4][c:5](-[c:8]2[n:9][cH:10][c:11]([OH:14])[cH:12][n:13]2)[cH:6][cH:7]1.[C:15](=[O:16])([O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[N:22]1[CH2:23][CH2:24][CH:25]([CH2:28][OH:29])[CH2:26][CH2:27]1.[CH2:63]1[O:64][CH2:65][CH2:66][CH2:67]1.[O:49]=[C:50]([O:51][CH:52]([CH3:53])[CH3:54])[N:55]=[N:56][C:57]([O:58][CH:59]([CH3:60])[CH3:61])=[O:62].[c:30]1([P: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>>[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][cH:10][c:11]([O:14][CH2:28][CH:25]3[CH2:24][CH2:23][N:22]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:27][CH2:26]3)[cH:12][n:13]2)[cH:6][cH:7]1