HRID2321100

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID14763060

3-Methoxybenzene-1-sulfonamide

C7H9NO3S

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：COc1cccc(S(=O)(=O)NC(=O)NCCc2ccc(-n3nc(C)c(-c4ccccc4)c3C)cc2)c1

HCID22244604

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0c568390aac54f1590a2fc5a660e673f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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