HRID1118211

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID813

Potassium cation

K+

2 次

HCID19660

Carbonate

CO3-2

HCID67184

1-Bromopyrrolidine-2,5-dione

C4H4BrNO2

HCID90495

Di-tert-butyl dicarbonate

C10H18O5

结构：CC(C)(C)OC(=O)NC(CC(=O)N1CCn2c(cnc2C(F)(F)F)C1)Cc1cc(F)c(F)cc1F

HCID57518398

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC(CC(=O)N1CCn2c(C(F)(F)F)nc(Br)c2C1)Cc1cc(F)c(F)cc1F

HCID57518399

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e66ed5d872074a85a6f946a7ece47b69
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Br:36][N:37]1[C:38](=[O:39])[CH2:40][CH2:41][C:42]1=[O:43].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][C:10]([N:11]1[CH2:12][c:13]2[n:14]([c:17]([C:20]([F:21])([F:22])[F:23])[n:18][cH:19]2)[CH2:15][CH2:16]1)=[O:24])[CH2:25][c:26]1[c:27]([F:34])[cH:28][c:29]([F:33])[c:30]([F:32])[cH:31]1)=[O:35].[C:44](=[O:45])([O-:46])[O-:47].[CH3:50][C:51]([O:52][C:53]([O:54][C:55]([O:56][C:57]([CH3:58])([CH3:59])[CH3:60])=[O:61])=[O:62])([CH3:63])[CH3:64].[CH3:65][CH2:66][OH:67].[K+:48].[K+:49]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][C:10]([N:11]1[CH2:12][c:13]2[n:14]([c:17]([C:20]([F:21])([F:22])[F:23])[n:18][c:19]2[Br:36])[CH2:15][CH2:16]1)=[O:24])[CH2:25][c:26]1[c:27]([F:34])[cH:28][c:29]([F:33])[c:30]([F:32])[cH:31]1)=[O:35]