HRID94835

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID7515

N-Methylaniline

C7H9N

结构：COc1cc(Cl)c(-c2cnc(C(F)(F)F)cc2C#N)cc1S(=O)(=O)Cl

HCID86643505

未命名化合物

PRODUCTS

生成物

结构：COc1cc(Cl)c(-c2cnc(C(F)(F)F)cc2C#N)cc1S(=O)(=O)N(C)c1ccccc1

HCID59410236

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bc267ae8c9ed4e5188c1f4b8a9303bc7
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

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