HRID180912

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID34005

2-Thiophenemethylamine

C5H7NS

HCID81531

Diisopropylethylamine

C8H19N

HCID121724

2-Chloro-6-methylnicotinic acid

C7H6ClNO2

HCID4641409

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

C10H15N6O+

PRODUCTS

生成物

HCID86628836

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e1934ff8f6d84fe8931a4d5670de17a9
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

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