HRID92893

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl Acetate

C4H8O2

HCID28486

Lithium ion

Li+

HCID74089

Valeryl chloride, 5-chloro-

C5H8Cl2O

HCID669039

未命名化合物

HCID5062348

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

产物

HCID22719721

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-2ff436f9a03e4b2d8d1e75bfe75c1880
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

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