HRID102736

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID81531

Diisopropylethylamine

C8H19N

HCID10969393

未命名化合物

HCID22989255

未命名化合物

PRODUCTS

产物

HCID22989383

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-5a3f51852f754fdb982e377bbc6544f2
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

[CH2:25]([CH3:26])[O:27][C:28]([CH2:29][NH:30][C:31](=[O:32])[c:33]1[n:34][c:35]2[n:36]([n:37][c:38]([Cl:41])[cH:39][cH:40]2)[cH:42]1)=[O:43].[CH2:44]([N:45]([CH:46]([CH3:47])[CH3:48])[CH:49]([CH3:50])[CH3:51])[CH3:52].[CH3:54][N:55]1[CH2:56][CH2:57][CH2:58][C:59]1=[O:60].[OH2:53].[c:1]1([CH:7]([O:8][CH:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][CH2:17][NH2:18])[CH2:13][CH2:14]2)[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([O:8][CH:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][CH2:17][NH:18][c:38]3[n:37][n:36]4[c:35]([n:34][c:33]([C:31]([NH:30][CH2:29][C:28]([O:27][CH2:25][CH3:26])=[O:43])=[O:32])[cH:42]4)[cH:40][cH:39]3)[CH2:13][CH2:14]2)[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1