HRID318095

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID9886

Hexafluorophosphate ion

F6P-

HCID13222

2-Phenylisobutyric acid

C10H12O2

HCID79832

3,4-Dimethoxybenzylamine

C9H13NO2

HCID81531

Diisopropylethylamine

C8H19N

HCID4641409

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

C10H15N6O+

PRODUCTS

生成物

HCID22026295

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-73b4e8301ea143a0bf4dd948262c0d50
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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