HRID311004

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID947

Nitrogen

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID58042381

3-Chloro-2-cyclopropyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

C14H19BClNO2

HCID58042397

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)NC(=O)c1cc(Cl)c(Cc2cnc(C3CC3)c(Cl)c2)cc1F

HCID58042502

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-922595fc68f648469507c650b66a51cb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br:20][CH2:21][c:22]1[cH:23][c:24]([F:36])[c:25]([C:26](=[O:27])[NH:28][S:29](=[O:30])(=[O:31])[CH3:32])[cH:33][c:34]1[Cl:35].[C:37](=[O:38])([O-:39])[O-:40].[Cl:1][c:2]1[c:3]([CH:17]2[CH2:18][CH2:19]2)[n:4][cH:5][c:6]([B:8]2[O:9][C:10]([CH3:11])([CH3:12])[C:13]([CH3:14])([CH3:15])[O:16]2)[cH:7]1.[K+:41].[K+:42].[N:43]#[N:44].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[OH2:45]>>[Cl:1][c:2]1[c:3]([CH:17]2[CH2:18][CH2:19]2)[n:4][cH:5][c:6]([CH2:21][c:22]2[cH:23][c:24]([F:36])[c:25]([C:26](=[O:27])[NH:28][S:29](=[O:30])(=[O:31])[CH3:32])[cH:33][c:34]2[Cl:35])[cH:7]1