HRID153964

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3283

Diethyl Ether

C4H10O

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID67672

2-Chloro-4'-fluoropropiophenone

C9H8ClFO

HCID18940817

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2[nH]cc(CC3=CCCN(CCC(=O)c4ccc(F)cc4)C3)c2c1

HCID18940881

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-48792e3a28254aedb3d109aaec48be36
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

[CH2:43]([Cl:44])[Cl:45].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:20][O:21][c:22]1[cH:23][c:24]2[c:25]([CH2:31][C:32]3=[CH:37][CH2:36][CH2:35][NH:34][CH2:33]3)[cH:26][nH:27][c:28]2[cH:29][cH:30]1.[CH3:38][CH2:39][O:40][CH2:41][CH3:42].[Cl:8][CH2:9][CH2:10][C:11](=[O:12])[c:13]1[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]1>>[CH2:9]([CH2:10][C:11](=[O:12])[c:13]1[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]1)[N:34]1[CH2:33][C:32]([CH2:31][c:25]2[c:24]3[cH:23][c:22]([O:21][CH3:20])[cH:30][cH:29][c:28]3[nH:27][cH:26]2)=[CH:37][CH2:36][CH2:35]1