HRID961327

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID81531

Diisopropylethylamine

C8H19N

HCID16227644

1-Cyclopropylpiperidin-4-amine

C8H16N2

HCID16782487

4-Fluoro-3-nitrobenzene-1-sulfonamide

C6H5FN2O4S

PRODUCTS

生成物

结构：NS(=O)(=O)c1ccc(NC2CCN(C3CC3)CC2)c([N+](=O)[O-])c1

HCID26042751

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-707b891807a84d47b948d3d045ecf3f1
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:39][N:40]([CH3:41])[c:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1.[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[CH:15]1([N:18]2[CH2:19][CH2:20][CH:21]([NH2:24])[CH2:22][CH2:23]2)[CH2:16][CH2:17]1.[CH:25]([N:26]([CH2:27][CH3:28])[CH:29]([CH3:30])[CH3:31])([CH3:32])[CH3:33].[F:1][c:2]1[c:3]([N+:12](=[O:13])[O-:14])[cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH2:11])[cH:6][cH:7]1.[Na+:58].[O-:54][C:55]([OH:56])=[O:57].[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1>>[c:2]1([NH:24][CH:21]2[CH2:20][CH2:19][N:18]([CH:15]3[CH2:16][CH2:17]3)[CH2:23][CH2:22]2)[c:3]([N+:12](=[O:13])[O-:14])[cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH2:11])[cH:6][cH:7]1