HRID282439

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID97447

1-(4-Chlorophenyl)cyclopentanecarboxylic acid

C12H13ClO2

HCID16757468

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(NC(=O)C(C)C)cc1C1CCN(CCCNC(=O)C2(c3ccc(Cl)cc3)CCCC2)CC1

HCID21051136

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1bc1443f26364d5b85e9fb501faf1a00
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

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