HRID283908

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

HCID10149073

未命名化合物

HCID22574363

未命名化合物

PRODUCTS

产物

HCID10311975

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-60934f3e37f54b99ad9b236c35f61c3e
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

[CH3:26][NH:27][CH2:28][CH:29]([OH:30])[c:31]1[n:32][c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2[cH:39][cH:40]1.[CH:41]([N:42]([CH:43]([CH3:44])[CH3:45])[CH2:46][CH3:47])([CH3:48])[CH3:49].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[c:11](=[O:23])[c:12]3[c:13]([n:14]([CH3:16])[cH:15]2)[c:17]([CH3:22])[c:18]([CH2:20][Cl:21])[s:19]3)[cH:24][cH:25]1.[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH2:55]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[c:11](=[O:23])[c:12]3[c:13]([n:14]([CH3:16])[cH:15]2)[c:17]([CH3:22])[c:18]([CH2:20][N:27]([CH3:26])[CH2:28][CH:29]([OH:30])[c:31]2[n:32][c:33]4[cH:34][cH:35][cH:36][cH:37][c:38]4[cH:39][cH:40]2)[s:19]3)[cH:24][cH:25]1