HRID122866

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

HCID2773497

4-Chloro-5-(trifluoromethyl)benzene-1,2-diamine

C7H6ClF3N2

HCID4641409

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

C10H15N6O+

HCID67775357

未命名化合物

PRODUCTS

生成物

结构：Nc1cc(Cl)c(C(F)(F)F)cc1NC(=O)CCC1CC(=O)C1

HCID67773908

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b8f357e0991d4376a4d9492773c6935d
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

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