HRID685849

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID15718789

未命名化合物

HCID18333494

未命名化合物

PRODUCTS

产物

HCID9895457

1-(3,4,5-trimethoxybenzyl)-3-(3-(4-(1H-benzimidazol-2-yl-amino)piperidin-1-yl)propyl)-3-(4-fluorophenylmethyl)-2-oxopyrrolidine

C36H44FN5O4

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-38be6bda49a14da897904d3c0ed9a813
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

[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][N:7]2[C:8](=[O:27])[C:9]([CH2:12][CH2:13][CH2:14][S:15]([CH3:16])(=[O:17])=[O:18])([CH2:19][c:20]3[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]3)[CH2:10][CH2:11]2)[cH:28][c:29]([O:33][CH3:34])[c:30]1[O:31][CH3:32].[nH:35]1[c:36]([NH:44][CH:45]2[CH2:46][CH2:47][NH:48][CH2:49][CH2:50]2)[n:37][c:38]2[c:39]1[cH:40][cH:41][cH:42][cH:43]2>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][N:7]2[C:8](=[O:27])[C:9]([CH2:12][CH2:13][CH2:14][N:48]3[CH2:47][CH2:46][CH:45]([NH:44][c:36]4[nH:35][c:39]5[c:38]([n:37]4)[cH:43][cH:42][cH:41][cH:40]5)[CH2:50][CH2:49]3)([CH2:19][c:20]3[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]3)[CH2:10][CH2:11]2)[cH:28][c:29]([O:33][CH3:34])[c:30]1[O:31][CH3:32]