HRID174352

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID53397501

未命名化合物

结构：CCOC(OCC)C(C)N(Cc1csc2ccccc12)C(=O)C(C)N

HCID67075493

未命名化合物

PRODUCTS

生成物

结构：CCOC(OCC)C(C)N(Cc1csc2ccccc12)C(=O)C(C)NC(=O)CN(C)NC(=O)NCc1ccc(Cl)cc1

HCID67075269

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b903d081f3be479d9a406268205c4449
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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