HRID197354

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

结构：CNC(=O)C(NC(=O)c1nc(-c2ccccc2)n2c1CN(C(=O)OC(C)(C)C)CC2)C(C)(C)C

HCID66931757

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)C(NC(=O)c1nc(-c2ccccc2)n2c1CNCC2)C(C)(C)C

HCID66931907

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-aa451740f90543069d7f773888aae742
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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