HRID2146838

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

O-benzotriazol-1-yl-tetramethyluronium

C11H16N5O+

HCID24730367

Methyl 2-amino-1H-benzimidazole-4-carboxylate

C9H9N3O2

HCID66940404

未命名化合物

PRODUCTS

产物

HCID58724459

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-1b5ede0afd674b0ca5a43be9929538da
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

[CH3:51][O:52][C:53](=[O:54])[c:55]1[cH:56][cH:57][cH:58][c:59]2[nH:60][c:61]([NH2:64])[n:62][c:63]12.[CH:42]([N:43]([CH2:44][CH3:45])[CH:46]([CH3:47])[CH3:48])([CH3:49])[CH3:50].[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[P-:18]([F:19])([F:20])([F:21])([F:22])([F:23])[F:24].[c:1]1([C:7]#[C:8][c:9]2[cH:10][cH:11][cH:12][c:13]([C:15](=[O:16])[OH:17])[n:14]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[n:25]1([O:26][C:27]([N:28]([CH3:29])[CH3:30])=[N+:31]([CH3:32])[CH3:33])[c:34]2[cH:35][cH:36][cH:37][cH:38][c:39]2[n:40][n:41]1>>[c:1]1([C:7]#[C:8][c:9]2[cH:10][cH:11][cH:12][c:13]([C:15](=[O:17])[NH:64][c:61]3[nH:60][c:59]4[cH:58][cH:57][cH:56][c:55]([C:53]([O:52][CH3:51])=[O:54])[c:63]4[n:62]3)[n:14]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1