HRID1575774

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

HCID104727

Aluminum Cation

Al+3

HCID166653

Hydride

H-

4 次

结构：CCOC(=O)c1cc(C(C)NC(=O)C2CC2(C)c2ccc(C(F)(F)F)cc2)ccc1NS(C)(=O)=O

HCID178468914

未命名化合物

PRODUCTS

生成物

结构：CC(NC(=O)C1CC1(C)c1ccc(C(F)(F)F)cc1)c1ccc(NS(C)(=O)=O)c(CO)c1

HCID70968395

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7ce16810e5894e4c91cf1b06e4ad1b24
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[Al+3:37].[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:1][S:2](=[O:3])(=[O:4])[NH:5][c:6]1[c:7]([C:8](=[O:9])[O:10][CH2:11][CH3:12])[cH:13][c:14]([CH:17]([CH3:18])[NH:19][C:20](=[O:21])[CH:22]2[C:23]([c:25]3[cH:26][cH:27][c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]3)([CH3:35])[CH2:24]2)[cH:15][cH:16]1.[H-:36].[H-:39].[H-:40].[H-:41].[Li+:38]>>[CH3:1][S:2](=[O:3])(=[O:4])[NH:5][c:6]1[c:7]([CH2:8][OH:9])[cH:13][c:14]([CH:17]([CH3:18])[NH:19][C:20](=[O:21])[CH:22]2[C:23]([c:25]3[cH:26][cH:27][c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]3)([CH3:35])[CH2:24]2)[cH:15][cH:16]1