HRID1238202

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID17654

2-(2-Aminoethyl)-5-methoxyindole

C11H14N2O

HCID4641409

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

C10H15N6O+

HCID66832107

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2c(CCNC(=O)c3cc(Cc4cccc(F)c4)on3)c[nH]c2c1

HCID66832090

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a22695a49358458f82525e622175d61a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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