HRID2328728

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID923

Sodium ion

Na+

HCID6212

Chloroform

CHCl3

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID24648

Sulfuryl chloride

Cl2O2S

HCID166653

Hydride

H-

HCID2777188

3-(Trifluoromethoxy)anisole

C8H7F3O2

HCID21905955

5-Chloro-3-hydroxy-3-(2-methoxyphenyl)-1,3-dihydro-2H-indol-2-one

C15H12ClNO3

PRODUCTS

生成物

结构：COc1ccc(S(=O)(=O)N2C(=O)C(O)(c3ccccc3OC)c3cc(Cl)ccc32)c(OC(F)(F)F)c1

HCID67429850

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6603f41310eb464798e57dac7284e48c
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

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