HRID800434

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

Dimethylformamide

C3H7NO

HCID7456

Methylparaben

C8H8O3

HCID19660

Carbonate

CO3-2

结构：CCC(C(c1ccc2nc(Br)sc2c1)n1ccnc1)N(C)C

HCID54762085

未命名化合物

PRODUCTS

生成物

结构：CCC(C(c1ccc2nc(Oc3ccc(C(=O)OC)cc3)sc2c1)n1ccnc1)N(C)C

HCID54760635

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fd60b7ee53724a0581962d8fd3e8fc77
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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