HRID1553981

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID7164590

3-[4-(Bromomethyl)phenyl]-5-methyl-1,2,4-oxadiazole

C10H9BrN2O

HCID57869998

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(-c2ccc(CN3CCN(c4nc(-c5ccncn5)cc(=O)n4C)C(C)C3)cc2)no1

HCID178432510

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9573e39e28894af39a628cde74079b90
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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