HRID2151662

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3032019

未命名化合物

结构：CC(Nc1c(Cl)ccc2c1CCN(C(=O)C(F)(F)F)CC2)c1cc(F)ccc1F

HCID88616735

未命名化合物

PRODUCTS

生成物

HCID3032019

未命名化合物

HCID57656500

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7287bc9ab62541b9a411861f7dc24996
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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