HRID312594

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID145424

3,5-Difluorophenylacetic acid

C8H6F2O2

结构：CC(C)CN1C(=O)C(NC(=O)C(C)N)C(=O)N(CC(C)C)c2ccccc21

HCID178448695

未命名化合物

PRODUCTS

生成物

结构：CC(C)CN1C(=O)C(NC(=O)C(C)NC(=O)Cc2cc(F)cc(F)c2)C(=O)N(CC(C)C)c2ccccc21

HCID178448694

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f8a3926cdd2a414ea4b7ccf837c7ebde
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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