HRID177391

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID14788214

未命名化合物

结构：CN(C(=O)c1cc(Br)cc(C(F)(F)F)c1)C1CCNCC1c1ccc(F)cc1

HCID87628395

未命名化合物

PRODUCTS

生成物

结构：CC(=O)NC1CCC(C(=O)N2CCC(N(C)C(=O)c3cc(Br)cc(C(F)(F)F)c3)C(c3ccc(F)cc3)C2)CC1

HCID68935938

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a589e0ae29dd4299806f0608c200fac8
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

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