HRID663661

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID101941

(Dimethylamino)trimethylstannane

C5H15NSn

结构：CCOC(=O)N1c2ccc(C(F)(F)F)cc2C(Nc2ncc(Br)c(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n2)CC1CC

HCID178473187

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)N1c2ccc(C(F)(F)F)cc2C(Nc2ncc(N(C)C)c(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n2)CC1CC

HCID178473203

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4f4e0f75e31e45b79032d0dc18ebf24d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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