HRID104910

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID263

1-Butanol

C4H10O

HCID81531

Diisopropylethylamine

C8H19N

HCID4233041

3-Boc-aminopiperidine

C10H20N2O2

HCID60205508

tert-butyl 2-(5-bromo-4-fluoro-1H-pyrrolo[2,3-b]pyridin-3-ylcarbamoyl)morpholine-4-carboxylate

C17H20BrFN4O4

PRODUCTS

产物

HCID67045495

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-91e9e24151944c48b67d311115634a7b
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[c:3]([F:27])[c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2[NH:11][C:12](=[O:13])[CH:14]1[O:15][CH2:16][CH2:17][N:18]([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:19]1.[CH2:51]([OH:52])[CH2:53][CH2:54][CH3:55].[CH:42]([N:43]([CH2:44][CH3:45])[CH:46]([CH3:47])[CH3:48])([CH3:49])[CH3:50].[NH:28]1[CH2:29][CH:30]([NH:34][C:35]([O:36][C:37]([CH3:38])([CH3:39])[CH3:40])=[O:41])[CH2:31][CH2:32][CH2:33]1>>[Br:1][c:2]1[c:3]([N:28]2[CH2:29][CH:30]([NH:34][C:35]([O:36][C:37]([CH3:38])([CH3:39])[CH3:40])=[O:41])[CH2:31][CH2:32][CH2:33]2)[c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2[NH:11][C:12](=[O:13])[CH:14]1[O:15][CH2:16][CH2:17][N:18]([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:19]1