HRID203144

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID59259225

5-(Pyrazin-2-yl)pyridin-2-amine

C9H8N4

结构：Cc1cc(CC(=O)O)cnc1-c1cc[n+]([O-])c(C)c1

HCID67134731

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(CC(=O)Nc2ccc(-c3cnccn3)cn2)cnc1-c1cc[n+]([O-])c(C)c1

HCID58447918

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-45c13a6ff9404c16a13b003e1178e97d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:1](=[O:2])([OH:3])[CH2:4][c:5]1[cH:6][c:7]([CH3:19])[c:8](-[c:11]2[cH:12][c:13]([CH3:18])[n+:14]([O-:17])[cH:15][cH:16]2)[n:9][cH:10]1.[CH2:33]1[CH2:34][CH2:35][CH:36]([N:37]=[C:38]=[N:39][CH:40]2[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45]2)[CH2:46][CH2:47]1.[CH3:48][N:49]([CH3:50])[c:51]1[cH:52][cH:53][n:54][cH:55][cH:56]1.[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[n:20]1[c:21](-[c:26]2[cH:27][cH:28][c:29]([NH2:32])[n:30][cH:31]2)[cH:22][n:23][cH:24][cH:25]1>>[C:1](=[O:3])([CH2:4][c:5]1[cH:6][c:7]([CH3:19])[c:8](-[c:11]2[cH:12][c:13]([CH3:18])[n+:14]([O-:17])[cH:15][cH:16]2)[n:9][cH:10]1)[NH:32][c:29]1[cH:28][cH:27][c:26](-[c:21]2[n:20][cH:25][cH:24][n:23][cH:22]2)[cH:31][n:30]1