HRID204224

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID713136

(2-Aminophenyl)(pyrrolidin-1-yl)methanone

C11H14N2O

结构：CCOP(=O)(Cc1ccc(Nc2ncc(C(F)(F)F)c(Cl)n2)c(OC)c1)OCC

HCID86654002

未命名化合物

PRODUCTS

生成物

结构：CCOP(=O)(Cc1ccc(Nc2ncc(C(F)(F)F)c(Nc3ccccc3C(=O)N3CCCC3)n2)c(OC)c1)OCC

HCID58292909

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-432a3c49316e46b8b1c4ceb1c18ba282
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

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