HRID819167

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID673

Glycine, N,N-dimethyl-

C4H9NO2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

结构：COc1cc2c(Nc3c(Cl)cnc4c3OCO4)ncnc2cc1OCC1CCNCC1

HCID68541464

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(Nc3c(Cl)cnc4c3OCO4)ncnc2cc1OCC1CCN(C(=O)CN(C)C)CC1

HCID68546687

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a94fe9457b40429f987b26115bd1e23c
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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