HRID167741

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7369

Benzenesulfonyl chloride

C6H5ClO2S

HCID81531

Diisopropylethylamine

C8H19N

结构：COC(=O)CC(c1ccc(-c2ccccc2)cc1)n1cnc2cc(N)ccc21

HCID58653671

未命名化合物

PRODUCTS

生成物

结构：COC(=O)CC(c1ccc(-c2ccccc2)cc1)n1cnc2cc(NS(=O)(=O)c3ccccc3)ccc21

HCID58653660

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b1b9d07442fa44a28809b03e87ce196d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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