HRID215051

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

HCID4641409

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

C10H15N6O+

HCID11355484

5-methyl-1,3-oxazole-4-carboxylic Acid

C5H5NO3

HCID71294172

未命名化合物

PRODUCTS

生成物

结构：Cc1ocnc1C(=O)Nc1cnc(OCC(F)(F)F)c(C2CCCC2)c1

HCID71509593

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5c46f09cff2c444fbfbf35d38a56cd98
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

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