HRID96471

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID27281504

2-Amino-3-fluoro-N-methylbenzamide

C8H9FN2O

结构：CCOP(=O)(Cc1ccc(Nc2ncc(C(F)(F)F)c(Nc3ccc(F)cc3C(=O)NC)n2)c(OC)c1)OCC

HCID49822431

未命名化合物

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(Nc3c(F)cccc3C(=O)NC)n2)c(OC)c1)OCC

HCID58293038

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f857452fbe274af982a99dec607f6da6
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

[Cl:41][c:42]1[c:43]([C:44]([F:45])([F:46])[F:47])[cH:48][n:49][c:50]([NH:51][c:52]2[cH:53][cH:54][c:55]([CH2:56][P:57](=[O:58])([O:59][CH2:60][CH3:61])[O:62][CH2:63][CH3:64])[cH:65][c:66]2[O:67][CH3:68])[n:69]1.[F:1][c:2]1[cH:3][cH:4][c:5]([NH:8][c:9]2[n:10][c:11]([NH:19][c:20]3[c:21]([O:35][CH3:36])[cH:22][c:23]([CH2:24][P:25]([O:26][CH2:27][CH3:28])([O:29][CH2:30][CH3:31])=[O:32])[cH:33][cH:34]3)[n:12][cH:13][c:14]2[C:15]([F:16])([F:17])[F:18])[c:6]([C:7](=[O:37])[NH:38][CH3:39])[cH:40]1.[NH2:70][c:71]1[c:72]([C:73](=[O:74])[NH:75][CH3:76])[cH:77][cH:78][cH:79][c:80]1[F:81]>>[NH:8]([c:9]1[n:10][c:11]([NH:19][c:20]2[c:21]([O:35][CH3:36])[cH:22][c:23]([CH2:24][P:25]([O:26][CH2:27][CH3:28])([O:29][CH2:30][CH3:31])=[O:32])[cH:33][cH:34]2)[n:12][cH:13][c:14]1[C:15]([F:16])([F:17])[F:18])[c:71]1[c:72]([C:73](=[O:74])[NH:75][CH3:76])[cH:77][cH:78][cH:79][c:80]1[F:81]