HRID1153611

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID2115239

未命名化合物

HCID2756806

tert-Butyl methyl(piperidin-4-yl)carbamate

C11H22N2O2

PRODUCTS

生成物

结构：CN(C(=O)OC(C)(C)C)C1CCN(c2nnc(-c3ccc(F)cc3)c3ccccc23)CC1

HCID58157128

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b01d3a0daec94c6f88d400878198c1eb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C:19]([CH3:20])([CH3:21])([CH3:22])[O:23][C:24]([N:25]([CH:26]1[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]1)[CH3:32])=[O:33].[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[Cl:1][c:2]1[n:3][n:4][c:5](-[c:12]2[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]2)[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12.[Cl:46][CH2:47][Cl:48].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45]>>[c:2]1([N:29]2[CH2:28][CH2:27][CH:26]([N:25]([C:24]([O:23][C:19]([CH3:20])([CH3:21])[CH3:22])=[O:33])[CH3:32])[CH2:31][CH2:30]2)[n:3][n:4][c:5](-[c:12]2[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]2)[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12