HRID180806

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：Cc1cccc2oc(C(=O)Nc3ccc(-c4ccc(S(=O)(=O)NC(C(=O)OC(C)(C)C)C(C)C)cc4)cc3)nc12

HCID68712165

未命名化合物

PRODUCTS

生成物

结构：Cc1cccc2oc(C(=O)Nc3ccc(-c4ccc(S(=O)(=O)NC(C(=O)O)C(C)C)cc4)cc3)nc12

HCID68709862

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a936405ac820450b89d49083e3109822
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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