HRID176477

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID77703

p-Toluenesulphonyl isocyanate

C8H7NO3S

结构：OCCc1ccc(-n2nc(C(F)(F)F)cc2-c2ccccc2)cc1

HCID22244558

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(S(=O)(=O)NC(=O)OCCc2ccc(-n3nc(C(F)(F)F)cc3-c3ccccc3)cc2)cc1

HCID86759936

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a534e3b74dcb4b75826db8cd2aa949a3
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

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