HRID690000

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID21072494

未命名化合物

结构：CC(=O)N1CC(N)C(=O)N(CC(F)(F)F)c2ccccc21

HCID21072587

未命名化合物

PRODUCTS

生成物

结构：CC(=O)N1CC(NC(=O)C(C)C(=O)NCC(F)(F)C(F)(F)F)C(=O)N(CC(F)(F)F)c2ccccc21

HCID21072557

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6a50d9dbb91b4b19ad2ef051f47bfcf0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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