HRID160190

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID123238

1-Azabicyclo[2.2.2]octan-3-amine

C7H14N2

HCID4641409

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

C10H15N6O+

HCID59341426

5,7-Difluoro-2-benzofurancarboxylic acid

C9H4F2O3

PRODUCTS

生成物

结构：O=C(NC1CN2CCC1CC2)c1cc2cc(F)cc(F)c2o1

HCID72259142

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a38acf556bbe40549793285d4ffd0350
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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