HRID100796

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID53397489

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)NCc1ccccc1

HCID67075346

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-707820f9fd7b471eaa03355f9f397d30
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[NH:11][N:12]([CH3:13])[CH2:14][C:15](=[O:16])[OH:17].[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)[CH3:42]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[NH:11][N:12]([CH3:13])[CH2:14][C:15](=[O:17])[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]1[c:34]2[c:35]([s:36][cH:37]1)[cH:38][cH:39][cH:40][cH:41]2)[CH3:42]