HRID184354

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID8471

Triethylamine

C6H15N

HCID123238

1-Azabicyclo[2.2.2]octan-3-amine

C7H14N2

结构：CCOc1ccc(-c2cc3[nH]c(CCl)nc3c(C#N)n2)cc1C(F)(F)F

HCID58938114

未命名化合物

PRODUCTS

生成物

结构：CCOc1ccc(-c2cc3[nH]c(CNC4CN5CCC4CC5)nc3c(C#N)n2)cc1C(F)(F)F

HCID58938126

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-38668434cc6f448fa48c41488cbea627
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[Cl:1][CH2:2][c:3]1[nH:4][c:5]2[c:6]([c:7]([C:24]#[N:25])[n:8][c:9](-[c:11]3[cH:12][c:13]([C:20]([F:21])([F:22])[F:23])[c:14]([O:17][CH2:18][CH3:19])[cH:15][cH:16]3)[cH:10]2)[n:26]1.[ClH:27].[ClH:28].[NH2:29][CH:30]1[CH2:31][N:32]2[CH2:33][CH2:34][CH:35]1[CH2:36][CH2:37]2>>[CH2:2]([c:3]1[nH:4][c:5]2[c:6]([c:7]([C:24]#[N:25])[n:8][c:9](-[c:11]3[cH:12][c:13]([C:20]([F:21])([F:22])[F:23])[c:14]([O:17][CH2:18][CH3:19])[cH:15][cH:16]3)[cH:10]2)[n:26]1)[NH:29][CH:30]1[CH2:31][N:32]2[CH2:33][CH2:34][CH:35]1[CH2:36][CH2:37]2