HRID113012

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID9960

3-Furanol, tetrahydro-

C4H8O2

结构：C#Cc1cc(CNC(=O)C=Cc2ccc(C(F)(F)F)nc2Cl)cc(F)c1NS(C)(=O)=O

HCID74382385

未命名化合物

PRODUCTS

生成物

结构：C#Cc1cc(CNC(=O)C=Cc2ccc(C(F)(F)F)nc2OC2CCOC2)cc(F)c1NS(C)(=O)=O

HCID74382685

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a83051e281794a0f942e7bf8ed247322
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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