HRID85800

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID81531

Diisopropylethylamine

C8H19N

结构：O=S(=O)(Cl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID520945

3,5-Bis(trifluoromethyl)benzenesulphonyl chloride

C8H3ClF6O2S

结构：CC(C)(C)OC(=O)COc1c(F)c(Cl)cc2c1CCCC2N

HCID59192499

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)COc1c(F)c(Cl)cc2c1CCCC2NS(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID59192509

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-36218a92965f4f1f8099f88ab1aae5f2
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][O:8][c:9]1[c:10]([F:21])[c:11]([Cl:20])[cH:12][c:13]2[c:18]1[CH2:17][CH2:16][CH2:15][CH:14]2[NH2:19])=[O:22].[CH:41]([N:42]([CH:43]([CH3:44])[CH3:45])[CH2:46][CH3:47])([CH3:48])[CH3:49].[F:23][C:24]([c:25]1[cH:26][c:27]([S:35](=[O:36])(=[O:37])[Cl:38])[cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[cH:30]1)([F:39])[F:40].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][O:8][c:9]1[c:10]([F:21])[c:11]([Cl:20])[cH:12][c:13]2[c:18]1[CH2:17][CH2:16][CH2:15][CH:14]2[NH:19][S:35]([c:27]1[cH:26][c:25]([C:24]([F:23])([F:39])[F:40])[cH:30][c:29]([C:31]([F:32])([F:33])[F:34])[cH:28]1)(=[O:36])=[O:37])=[O:22]