HRID107333

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

Dimethylformamide

C3H7NO

HCID7418

3-Methylbenzoic acid

C8H8O2

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+

HCID58268019

未命名化合物

PRODUCTS

产物

HCID44540402

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-7459b6cabebd48bcb03f13f2c8d8af46
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

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