HRID117513

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7370

Benzenesulfonamide

C6H7NO2S

HCID166653

Hydride

H-

结构：Cc1nn(-c2ccc(CCNC(=O)Oc3ccccc3)cc2)c(C)c1-c1ccccc1

HCID22244550

未命名化合物

PRODUCTS

生成物

结构：Cc1nn(-c2ccc(CCNC(=O)NS(=O)(=O)c3ccccc3)cc2)c(C)c1-c1ccccc1

HCID22244539

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0814a587c4fd45468f9644e2819578fb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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