HRID316248

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID2773987

1-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

C10H17BN2O2

HCID59375688

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1nc2cc[nH]c(=O)c2c2cc(-c3cnn(C)c3)ccc12

HCID59375386

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fa0de1b0177b4f1db0f6969ba21fb082
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

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