HRID313733

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID524508

6-Hydroxyindole

C8H7NO

HCID21874823

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(Oc3ccc4cc[nH]c4c3)ncnc2cc1OCCCS(C)(=O)=O

HCID22030863

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1513a6a3b93547ef8c87f8be88ae5ae4
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

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