HRID1125067

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID21885

2-Dimethylaminopyridine

C7H10N2

HCID2777907

O-tert-butylhydroxylamine

C4H11NO

结构：COc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3ccccc3)CC2C(=O)O)cc1

HCID18675481

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3ccccc3)CC2C(=O)NOC(C)(C)C)cc1

HCID18675468

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-91130377332242f6a1d6e8a33da06956
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

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