HRID1992467

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID82408

Isopropyl sulfonyl chloride

C3H7ClO2S

HCID143452

tert-Butyl piperazine-1-carboxylate

C9H18N2O2

HCID22562851

1-(Propane-2-sulfonyl)piperazine

C7H16N2O2S

结构：CC(C)N1CCN(C(=O)c2ccc3[nH]c(C(=O)N4CCN(S(C)(=O)=O)CC4)cc3c2)CC1

HCID68538245

未命名化合物

2 次

PRODUCTS

生成物

结构：CC(C)N1CCN(C(=O)c2ccc3[nH]c(C(=O)N4CCN(S(=O)(=O)C(C)C)CC4)cc3c2)CC1

HCID68534115

未命名化合物

收率 87%

PROCEDURE

实验过程

The title compound was synthesized in analogy to example 1, from 5-(4-isopropyl-piperazine-1-carbonyl)-1H-indole-2-carboxylic acid hydrochloride (example 1, intermediate b) and 1-(1-methylethylsulfonyl)piperazine (prepared in analogy to WO2003064413 using isopropylsulfonyl chloride and tert-butyl 1-piperazinecarboxylate) to afford the desired product as a light-brown solid (87%). MS (ISP): 490.3 (M+H)+.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ccd7b355e89e409f937b6791ba6e6967
来源数据集: uspto-grants-2010_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07648979B2
来源说明: uspto-grants-2010_01

反应 SMILES

[CH:1]([N:4]1[CH2:9][CH2:8][N:7]([C:10]([C:12]2[CH:13]=[C:14]3[C:18](=[CH:19][CH:20]=2)[NH:17][C:16]([C:21](N2CCN(S(C)(=O)=O)CC2)=[O:22])=[CH:15]3)=[O:11])[CH2:6][CH2:5]1)([CH3:3])[CH3:2].[CH3:33][CH:34]([S:36]([N:39]1[CH2:44][CH2:43][NH:42][CH2:41][CH2:40]1)(=[O:38])=[O:37])[CH3:35].C(S(Cl)(=O)=O)(C)C.N1(C(OC(C)(C)C)=O)CCNCC1>>[CH:1]([N:4]1[CH2:9][CH2:8][N:7]([C:10]([C:12]2[CH:13]=[C:14]3[C:18](=[CH:19][CH:20]=2)[NH:17][C:16]([C:21]([N:42]2[CH2:41][CH2:40][N:39]([S:36]([CH:34]([CH3:33])[CH3:35])(=[O:37])=[O:38])[CH2:44][CH2:43]2)=[O:22])=[CH:15]3)=[O:11])[CH2:6][CH2:5]1)([CH3:3])[CH3:2]