HRID169940

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

结构：CN(C(=O)C(Cc1ccc2ccccc2c1)N(C)C(=O)C=CCC(C)(C)NC(=O)OC(C)(C)C)C(CNS(C)(=O)=O)Cc1ccccc1

HCID76125572

未命名化合物

PRODUCTS

生成物

结构：CN(C(=O)C(Cc1ccc2ccccc2c1)N(C)C(=O)C=CCC(C)(C)N)C(CNS(C)(=O)=O)Cc1ccccc1

HCID178485622

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0b94dd84ce5c42c693ae7e3ea302e76f
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

[C:1]([O:2][C:3](=[O:4])[NH:7][C:8]([CH2:9][CH:10]=[CH:11][C:12]([N:13]([CH3:14])[CH:15]([CH2:16][c:17]1[cH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][c:24]2[cH:25][cH:26]1)[C:27]([N:28]([CH3:29])[CH:30]([CH2:31][NH:32][S:33](=[O:34])(=[O:35])[CH3:36])[CH2:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1)=[O:44])=[O:45])([CH3:46])[CH3:47])([CH3:5])([CH3:6])[CH3:48].[Cl:56][CH2:57][Cl:58].[OH:49][C:50]([C:51]([F:52])([F:53])[F:54])=[O:55]>>[NH2:7][C:8]([CH2:9][CH:10]=[CH:11][C:12]([N:13]([CH3:14])[CH:15]([CH2:16][c:17]1[cH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][c:24]2[cH:25][cH:26]1)[C:27]([N:28]([CH3:29])[CH:30]([CH2:31][NH:32][S:33](=[O:34])(=[O:35])[CH3:36])[CH2:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1)=[O:44])=[O:45])([CH3:46])[CH3:47]