HRID1203116

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID702

Ethanol

C2H6O

结构：CN(C)C=NS(=O)(=O)c1ccccc1-c1ccc(Cn2c(-c3ccccc3)nc(-c3ccccc3)c2-c2ccccc2)cc1

HCID70144593

未命名化合物

PRODUCTS

生成物

结构：NS(=O)(=O)c1ccccc1-c1ccc(Cn2c(-c3ccccc3)nc(-c3ccccc3)c2-c2ccccc2)cc1

HCID18400113

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f1fcb087873c4130b8618275378c20a8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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