HRID729624

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6395

Methanesulfonic acid

CH4O3S

结构：Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2cnc(N3CCN(C(=O)C(C)(C)C)CC3)c3ccccc23)cc1

HCID69052629

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)O.Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2cnc(N3CCN(C(=O)C(C)(C)C)CC3)c3ccccc23)cc1

HCID86760942

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID6344

Dichloromethane

CH2Cl2

PROCEDURE

实验过程

Stir 1-(5-tert-butyl-2-p-tolyl-2H-pyrazol-3-yl)-3-{1-[4-(2,2-dimethyl-propionyl)-piperazin-1-yl]-isoquinolin-4-yl}-urea at room temperature. Add 1N methanesulfonic acid solution in dichloromethane to form the title compound. LCMS ES+ (m/z) 568 [M+H].

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-96d17d6f9df3449bab1d0a4b1aee0362
来源数据集: uspto-grants-2009_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07582638B2
来源说明: uspto-grants-2009_09

反应 SMILES

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