HRID666165

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

结构：Cc1ccc(Cc2cnc(N[N+](=O)[O-])[nH]c2=O)cn1

HCID3018360

N-{4-Hydroxy-5-[(6-methylpyridin-3-yl)methyl]pyrimidin-2-yl}nitramide

C11H11N5O3

HCID19831051

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(Cc2cnc(NCCN(Cc3ccccc3)c3ccccn3)[nH]c2=O)cn1

HCID54180461

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a90d2281237c48be96c4119b83f858b6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[N+:18]([NH:19][c:22]1[n:23][cH:24][c:25]([CH2:29][c:30]2[cH:31][n:32][c:33]([CH3:36])[cH:34][cH:35]2)[c:26](=[O:28])[nH:27]1)([O-:20])=[O:21].[NH2:1][CH2:2][CH2:3][N:4]([CH2:5][c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[c:12]1[n:13][cH:14][cH:15][cH:16][cH:17]1.[cH:37]1[cH:38][cH:39][n:40][cH:41][cH:42]1>>[NH:1]([CH2:2][CH2:3][N:4]([CH2:5][c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[c:12]1[n:13][cH:14][cH:15][cH:16][cH:17]1)[c:22]1[n:23][cH:24][c:25]([CH2:29][c:30]2[cH:31][n:32][c:33]([CH3:36])[cH:34][cH:35]2)[c:26](=[O:28])[nH:27]1