HRID2153492

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID67254174

未命名化合物

反应SMILES：CCOP(=O)(Cc1ccc(Nc2ncc(C(F)(F)F)c(Cl)n2)cc1)OCC

HCID86654003

未命名化合物

PRODUCTS

产物

反应SMILES：CCOP(=O)(Cc1ccc(Nc2ncc(C(F)(F)F)c(Nc3ccc(Br)c4ccn(C)c(=O)c34)n2)cc1)OCC

HCID58292966

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-07c9ae5f03e841dfb97efb98cc15c30c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

[Cl:1][c:2]1[n:3][c:4]([NH:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][P:18]([O:19][CH2:20][CH3:21])([O:22][CH2:23][CH3:24])=[O:25])[cH:26][cH:27]2)[n:5][cH:6][c:7]1[C:8]([F:9])([F:10])[F:11].[NH2:28][c:29]1[cH:30][cH:31][c:32]([Br:41])[c:33]2[cH:34][cH:35][n:36]([CH3:40])[c:37](=[O:39])[c:38]12>>[c:2]1([NH:28][c:29]2[cH:30][cH:31][c:32]([Br:41])[c:33]3[cH:34][cH:35][n:36]([CH3:40])[c:37](=[O:39])[c:38]23)[n:3][c:4]([NH:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][P:18]([O:19][CH2:20][CH3:21])([O:22][CH2:23][CH3:24])=[O:25])[cH:26][cH:27]2)[n:5][cH:6][c:7]1[C:8]([F:9])([F:10])[F:11]