HRID154549

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1140

Toluene

C7H8

HCID8471

Triethylamine

C6H15N

HCID62493

2,2-Dimethylpropanoyl chloride

C5H9ClO

HCID349728

4-Phenyl-1,3-oxazolidin-2-one

C9H9NO2

结构：O=C(O)C1CCC(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1

HCID58291856

未命名化合物

PRODUCTS

生成物

结构：O=C1OCC(c2ccccc2)N1C(=O)C1CCC(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1

HCID67224051

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-69de356b65014d00bfb3d05ffb692024
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:43]([Cl:44])(=[O:45])[C:46]([CH3:47])([CH3:48])[CH3:49].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[ClH:57].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([S:9](=[O:10])(=[O:11])[NH:12][CH:13]2[CH2:14][CH2:15][CH:16]([C:19](=[O:20])[OH:21])[CH2:17][CH2:18]2)[cH:7][cH:8]1)([F:22])[F:23].[c:24]1([CH:30]2[NH:31][C:32](=[O:35])[O:33][CH2:34]2)[cH:25][cH:26][cH:27][cH:28][cH:29]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([S:9](=[O:10])(=[O:11])[NH:12][CH:13]2[CH2:14][CH2:15][CH:16]([C:19](=[O:20])[N:31]3[CH:30]([c:24]4[cH:25][cH:26][cH:27][cH:28][cH:29]4)[CH2:34][O:33][C:32]3=[O:35])[CH2:17][CH2:18]2)[cH:7][cH:8]1)([F:22])[F:23]