HRID91596

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID70297

Benzenecarboperoxoic acid, 3-chloro-

C7H5ClO3

结构：Cc1ccc(S(=O)(=O)OC=CC2=C(C(=O)OC(c3ccccc3)c3ccccc3)N3C(=O)C(NC(=O)OC(C)(C)C)C3SC2)cc1

HCID54031420

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(S(=O)(=O)OC=CC2=C(C(=O)OC(c3ccccc3)c3ccccc3)N3C(=O)C(NC(=O)OC(C)(C)C)C3S(=O)C2)cc1

HCID54382653

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5d84d1e790b84cc09a3918c3b6a29364
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

[CH2:58]([Cl:59])[Cl:60].[CH:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)([c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[O:25][C:26](=[O:27])[C:28]1=[C:35]([CH:36]=[CH:37][O:38][S:39](=[O:40])(=[O:41])[c:42]2[cH:43][cH:44][c:45]([CH3:46])[cH:47][cH:48]2)[CH2:34][S:33][CH:32]2[N:29]1[C:30](=[O:57])[CH:31]2[NH:49][C:50](=[O:51])[O:52][C:53]([CH3:54])([CH3:55])[CH3:56].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]([C:7]([O:8][OH:10])=[O:9])[cH:11]1>>[O:9]=[S:33]1[CH:32]2[N:29]([C:28]([C:26]([O:25][CH:12]([c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)=[O:27])=[C:35]([CH:36]=[CH:37][O:38][S:39](=[O:40])(=[O:41])[c:42]3[cH:43][cH:44][c:45]([CH3:46])[cH:47][cH:48]3)[CH2:34]1)[C:30](=[O:57])[CH:31]2[NH:49][C:50](=[O:51])[O:52][C:53]([CH3:54])([CH3:55])[CH3:56]