HRID1141760

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID735150

4-bromopyridine-2-carboxylic acid

C6H4BrNO2

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

HCID16228097

3-(1,3,4-Oxadiazol-2-yl)aniline

C8H7N3O

PRODUCTS

生成物

HCID58102932

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6a6bbeb5ffd44893b49216b756449905
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:1][c:2]1[cH:3][c:4]([C:8](=[O:9])[OH:10])[n:5][cH:6][cH:7]1.[CH3:56][N:57]([CH3:58])[CH:59]=[O:60].[CH:47]([N:48]([CH:49]([CH3:50])[CH3:51])[CH2:52][CH3:53])([CH3:54])[CH3:55].[P-:23]([F:24])([F:25])([F:26])([F:27])([F:28])[F:29].[n:30]1([O:31][C:32]([N:33]([CH3:34])[CH3:35])=[N+:36]([CH3:37])[CH3:38])[c:39]2[n:40][cH:41][cH:42][cH:43][c:44]2[n:45][n:46]1.[o:11]1[c:12](-[c:16]2[cH:17][c:18]([NH2:22])[cH:19][cH:20][cH:21]2)[n:13][n:14][cH:15]1>>[Br:1][c:2]1[cH:3][c:4]([C:8](=[O:10])[NH:22][c:18]2[cH:17][c:16](-[c:12]3[o:11][cH:15][n:14][n:13]3)[cH:21][cH:20][cH:19]2)[n:5][cH:6][cH:7]1