HRID188032

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID9773

Ethanamine, 2,2,2-trifluoro-

C2H4F3N

HCID26255

Tetrafluoroborate

BF4-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

结构：CN(C1CCCC1)S(=O)(=O)c1ccc(-n2[nH]cc(C(CC(=O)[O-])c3ccccc3)c2=O)nc1

HCID86659758

未命名化合物

PRODUCTS

生成物

结构：CN(C1CCCC1)S(=O)(=O)c1ccc(-n2[nH]cc(C(CC(=O)NCC(F)(F)F)c3ccccc3)c2=O)nc1

HCID67455572

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-215ab34da63c435d8cf2167a8cc38df9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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