HRID319749

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID640792

1-Chloro-N,N,2-trimethylpropenylamine

C6H12ClN

HCID14146220

(1-Aminocyclopropyl)methanol

C4H9NO

HCID68799009

未命名化合物

PRODUCTS

生成物

结构：COCCOc1ncc(C(=O)NC2(CO)CC2)nc1-c1ccc(Cl)cc1

HCID68841479

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0bdd2e247f494218bbc74be3354325c6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:37]([N:38]([CH:39]([CH3:40])[CH3:41])[CH:42]([CH3:43])[CH3:44])[CH3:45].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([O:17][CH2:18][CH2:19][O:20][CH3:21])[n:10][cH:11][c:12]([C:14](=[O:15])[OH:16])[n:13]2)[cH:6][cH:7]1.[Cl:22][C:23]([N:24]([CH3:25])[CH3:26])=[C:27]([CH3:28])[CH3:29].[Cl:46][CH2:47][Cl:48].[ClH:30].[NH2:31][C:32]1([CH2:35][OH:36])[CH2:33][CH2:34]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([O:17][CH2:18][CH2:19][O:20][CH3:21])[n:10][cH:11][c:12]([C:14](=[O:16])[NH:31][C:32]3([CH2:35][OH:36])[CH2:33][CH2:34]3)[n:13]2)[cH:6][cH:7]1