HRID2328880

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

HCID8471

Triethylamine

C6H15N

结构：O=S(=O)(Cl)c1ccc(-c2ccc(C(F)(F)F)cc2)cc1

HCID3720102

4'-(Trifluoromethyl)[1,1'-biphenyl]-4-sulfonyl chloride

C13H8ClF3O2S

HCID178439395

未命名化合物

PRODUCTS

生成物

结构：CC(C)C1CC(NS(=O)(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)cc2)C(=O)N1OCc1ccccc1

HCID178439411

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7bd185cf93e24827ab20312b5af9160e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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