HRID673129

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

HCID813

Potassium cation

K+

3 次

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID57843322

N-(5-Bromo-2-chloropyridin-3-yl)benzenesulfonamide

C11H8BrClN2O2S

HCID68506217

未命名化合物

PRODUCTS

生成物

结构：CN(C)C1CCCN(c2cnc3ccc(-c4cnc(Cl)c(NS(=O)(=O)c5ccccc5)c4)cc3n2)C1

HCID57843447

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-685c2482b9824d53b3ea878f41949a5a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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