HRID799873

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID26255

Tetrafluoroborate

BF4-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID18321559

未命名化合物

结构：COC(=O)C(CC(=O)[O-])Cc1cc(Cl)c(N)c(C(F)(F)F)c1

HCID178500563

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(CC(=O)N1CCC(n2c(=O)[nH]c3c4ccccc4ncc32)CC1)Cc1cc(Cl)c(N)c(C(F)(F)F)c1

HCID68593425

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-950049eee47549339a4428e37f8a82fa
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

[B-:23]([F:24])([F:25])([F:26])[F:27].[CH2:45]([N:46]([CH:47]([CH3:48])[CH3:49])[CH:50]([CH3:51])[CH3:52])[CH3:53].[NH2:1][c:2]1[c:3]([Cl:22])[cH:4][c:5]([CH2:6][CH:7]([C:8](=[O:9])[O:10][CH3:11])[CH2:12][C:13](=[O:14])[O-:15])[cH:16][c:17]1[C:18]([F:19])([F:20])[F:21].[NH:54]1[CH2:55][CH2:56][CH:57]([n:60]2[c:61](=[O:73])[nH:62][c:63]3[c:64]2[cH:65][n:66][c:67]2[cH:68][cH:69][cH:70][cH:71][c:72]32)[CH2:58][CH2:59]1.[O:74]=[CH:75][N:76]([CH3:77])[CH3:78].[n:28]1([O:29][C:30]([N:31]([CH3:32])[CH3:33])=[N+:34]([CH3:35])[CH3:36])[c:37]2[cH:38][cH:39][cH:40][cH:41][c:42]2[n:43][n:44]1>>[NH2:1][c:2]1[c:3]([Cl:22])[cH:4][c:5]([CH2:6][CH:7]([C:8](=[O:9])[O:10][CH3:11])[CH2:12][C:13](=[O:15])[N:54]2[CH2:55][CH2:56][CH:57]([n:60]3[c:61](=[O:73])[nH:62][c:63]4[c:64]3[cH:65][n:66][c:67]3[cH:68][cH:69][cH:70][cH:71][c:72]43)[CH2:58][CH2:59]2)[cH:16][c:17]1[C:18]([F:19])([F:20])[F:21]