HRID97777

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID996

Phenol

C6H6O

HCID15450145

1-(Benzenesulfonyl)-1H-indol-5-amine

C14H12N2O2S

HCID69484701

未命名化合物

PRODUCTS

生成物

结构：CC(=O)OCC=Cc1ccc2ncnc(Nc3ccc4c(ccn4S(=O)(=O)c4ccccc4)c3)c2c1

HCID54063371

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-48aba038c3604c8ba453cd0294c3b07c
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

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