HRID1537495

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID11776

Triphenylphosphine

C18H15P

HCID67184

1-Bromopyrrolidine-2,5-dione

C4H4BrNO2

HCID70622

2-Amino-5-bromopyridine

C5H5BrN2

结构：Cc1nnnn1-c1ccc(C(CC2CCCC2)C(=O)O)cc1C(F)(F)F

HCID12019648

未命名化合物

PRODUCTS

生成物

结构：Cc1nnnn1-c1ccc(C(CC2CCCC2)C(=O)Nc2ccc(Br)cn2)cc1C(F)(F)F

HCID10186450

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e2afbba7949a4cda8f87c7780b423884
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[Br:20][N:21]1[C:22](=[O:23])[CH2:24][CH2:25][C:26]1=[O:27].[CH2:62]([Cl:63])[Cl:64].[CH:28]1([CH2:33][CH:34]([C:35](=[O:36])[OH:37])[c:38]2[cH:39][c:40]([C:50]([F:51])([F:52])[F:53])[c:41](-[n:44]3[n:45][n:46][n:47][c:48]3[CH3:49])[cH:42][cH:43]2)[CH2:29][CH2:30][CH2:31][CH2:32]1.[NH2:54][c:55]1[n:56][cH:57][c:58]([Br:61])[cH:59][cH:60]1.[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[CH:28]1([CH2:33][CH:34]([C:35](=[O:36])[NH:54][c:55]2[n:56][cH:57][c:58]([Br:61])[cH:59][cH:60]2)[c:38]2[cH:39][c:40]([C:50]([F:51])([F:52])[F:53])[c:41](-[n:44]3[n:45][n:46][n:47][c:48]3[CH3:49])[cH:42][cH:43]2)[CH2:29][CH2:30][CH2:31][CH2:32]1