HRID1208435

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID923

Sodium ion

Na+

2 次

HCID19660

Carbonate

CO3-2

HCID4142526

tert-Butyl hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carboxylate

C11H20N2O2

HCID16072436

6-Chloro-N-(3,5-dimethoxyphenyl)pyrazine-2-carboxamide

C13H12ClN3O3

PRODUCTS

生成物

结构：COc1cc(NC(=O)c2cncc(N3CC4CN(C(=O)OC(C)(C)C)CC4C3)n2)cc(OC)c1

HCID67265834

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d7395634d87a4d4dad7cc877263b92eb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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