HRID170770

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID13345

Triethyl phosphonoacetate

C8H17O5P

HCID4574913

未命名化合物

HCID19603806

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C=Cc1ccc2oc(-c3nc(C(C)(C)C)cs3)cc2c1

HCID53950033

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8fad64cf7db548f385776c9aef43d7a0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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