HRID419187

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COCN(c1cc(Cl)cnc1C(=O)Cl)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1

HCID57942241

未命名化合物

HCID57942276

未命名化合物

PRODUCTS

生成物

结构：COCN(c1cc(Cl)cnc1C(=O)N(c1ccn(C(=O)OC(C)(C)C)n1)C(C)C)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1

HCID57942189

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID8028

Tetrahydrofuran

C4H8O

PROCEDURE

实验过程

A mixture of 5-chloro-3-[(4-chloro-3-trifluoromethyl-benzenesulfonyl)-methoxymethyl-amino]-pyridine-2-carbonyl chloride (100 mg, 0.2 mmol), 3-isopropylamino-pyrazole-1-carboxylic acid tert-butyl ester (54 mg, 0.24 mmol), TEA (0.88 mL) in THF was stirred at RT for 2 hours and then purified by flash column to give 3-({5-chloro-3-[(4-chloro-3-trifluoromethyl-benzenesulfonyl)-methoxymethyl-amino]-pyridine-2-carbonyl}-isopropyl-amino)-pyrazole-1-carboxylic acid tert-butyl ester.

WORKUP

后处理

custompurified by flash column

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fe8a9f2852ad4050a79e07d9e52a6edb
来源数据集: uspto-grants-2012_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08093247B2
来源说明: uspto-grants-2012_01

反应 SMILES

[Cl:1][C:2]1[CH:3]=[C:4]([N:11]([S:15]([C:18]2[CH:23]=[CH:22][C:21]([Cl:24])=[C:20]([C:25]([F:28])([F:27])[F:26])[CH:19]=2)(=[O:17])=[O:16])[CH2:12][O:13][CH3:14])[C:5]([C:8](Cl)=[O:9])=[N:6][CH:7]=1.[C:29]([O:33][C:34]([N:36]1[CH:40]=[CH:39][C:38]([NH:41][CH:42]([CH3:44])[CH3:43])=[N:37]1)=[O:35])([CH3:32])([CH3:31])[CH3:30]>C1COCC1>[C:29]([O:33][C:34]([N:36]1[CH:40]=[CH:39][C:38]([N:41]([C:8]([C:5]2[C:4]([N:11]([S:15]([C:18]3[CH:23]=[CH:22][C:21]([Cl:24])=[C:20]([C:25]([F:26])([F:28])[F:27])[CH:19]=3)(=[O:17])=[O:16])[CH2:12][O:13][CH3:14])=[CH:3][C:2]([Cl:1])=[CH:7][N:6]=2)=[O:9])[CH:42]([CH3:44])[CH3:43])=[N:37]1)=[O:35])([CH3:32])([CH3:31])[CH3:30]