HRID1116893

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID53397500

未命名化合物

结构：CCOC(OCC)C(C)N(Cc1csc2ccccc12)C(=O)C(N)Cc1ccc(OC(C)(C)C)cc1

HCID67088283

未命名化合物

PRODUCTS

生成物

结构：CCOC(OCC)C(C)N(Cc1csc2ccccc12)C(=O)C(Cc1ccc(OC(C)(C)C)cc1)NC(=O)CONC(=O)NCc1ccc(Cl)cc1

HCID87263458

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-894c185c08c548338b97e6d494ee5fa4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8]([NH:9][O:10][CH2:11][C:12](=[O:13])[OH:14])=[O:15])[cH:16][cH:17]1.[NH2:18][CH:19]([C:20](=[O:21])[N:22]([CH:23]([CH:24]([O:25][CH2:26][CH3:27])[O:28][CH2:29][CH3:30])[CH3:31])[CH2:32][c:33]1[c:34]2[c:35]([s:36][cH:37]1)[cH:38][cH:39][cH:40][cH:41]2)[CH2:42][c:43]1[cH:44][cH:45][c:46]([O:49][C:50]([CH3:51])([CH3:52])[CH3:53])[cH:47][cH:48]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8]([NH:9][O:10][CH2:11][C:12](=[O:14])[NH:18][CH:19]([C:20](=[O:21])[N:22]([CH:23]([CH:24]([O:25][CH2:26][CH3:27])[O:28][CH2:29][CH3:30])[CH3:31])[CH2:32][c:33]2[c:34]3[c:35]([s:36][cH:37]2)[cH:38][cH:39][cH:40][cH:41]3)[CH2:42][c:43]2[cH:44][cH:45][c:46]([O:49][C:50]([CH3:51])([CH3:52])[CH3:53])[cH:47][cH:48]2)=[O:15])[cH:16][cH:17]1