HRID1209640

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID2794749

4'-Fluorobiphenyl-4-sulfonyl chloride

C12H8ClFO2S

结构：CCSC(c1ccccc1)C(NS(=O)(=O)c1ccc(-c2ccc(F)cc2)cc1)C(=O)OC

HCID70073650

未命名化合物

HCID77736632

未命名化合物

PRODUCTS

生成物

结构：CCSC(c1ccccc1)C(NS(=O)(=O)c1ccc(-c2ccc(F)cc2)cc1)C(=O)O

HCID23433397

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9358b09de24843858e8d91c35d0d06ee
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:73]([Cl:74])[Cl:75].[CH3:1][O:2][C:3]([CH:4]([CH:5]([c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[S:12][CH2:13][CH3:14])[NH:15][S:16](=[O:17])(=[O:18])[c:19]1[cH:20][cH:21][c:22](-[c:25]2[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]2)[cH:23][cH:24]1)=[O:32].[CH3:33][O:34][C:35](=[O:36])[CH:37]([NH2:38])[CH:39]([S:40][CH2:41][CH3:42])[c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[CH3:49][CH2:50][N:51]([CH2:52][CH3:53])[CH2:54][CH3:55].[F:56][c:57]1[cH:58][cH:59][c:60](-[c:61]2[cH:62][cH:63][c:64]([S:65]([Cl:66])(=[O:67])=[O:68])[cH:69][cH:70]2)[cH:71][cH:72]1>>[O:2]=[C:3]([CH:4]([CH:5]([c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[S:12][CH2:13][CH3:14])[NH:15][S:16](=[O:17])(=[O:18])[c:19]1[cH:20][cH:21][c:22](-[c:25]2[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]2)[cH:23][cH:24]1)[OH:32]