HRID812740

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID84468

Trifluoroacetate

C2F3O2-

HCID90495

Di-tert-butyl dicarbonate

C10H18O5

HCID2735655

4-tert-Butylbenzylamine

C11H17N

HCID178436620

未命名化合物

PRODUCTS

生成物

结构：C=Cc1cc(CNC(=O)NCc2ccc(C(C)(C)C)cc2)cc(F)c1NS(C)(=O)=O

HCID11852379

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1ecac511a82b4908b7833df79750e52f
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:13](=[O:14])([O:15][C:16]([O:17][C:18]([CH3:19])([CH3:20])[CH3:21])=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:9][NH2:10])[cH:11][cH:12]1.[CH2:58]([Cl:59])[Cl:60].[CH3:51][CH2:52][N:53]([CH2:54][CH3:55])[CH2:56][CH3:57].[CH3:61][N:62]([CH3:63])[c:64]1[cH:65][cH:66][n:67][cH:68][cH:69]1.[F:28][c:29]1[cH:30][c:31]([CH2:32][NH3+:33])[cH:34][c:35]([CH:42]=[CH2:43])[c:36]1[NH:37][S:38](=[O:39])(=[O:40])[CH3:41].[O-:44][C:45]([C:46]([F:47])([F:48])[F:49])=[O:50]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:9][NH:10][C:13](=[O:14])[NH:33][CH2:32][c:31]2[cH:30][c:29]([F:28])[c:36]([NH:37][S:38](=[O:39])(=[O:40])[CH3:41])[c:35]([CH:42]=[CH2:43])[cH:34]2)[cH:11][cH:12]1