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HRID1051139

反应详情

EQUATION

反应方程式

HRID 1051139 的结构方程式

REACTANTS

反应物

4
结构：Cl
HCID313

Hydrochloric Acid

ClH

结构：CO
HCID887

Methanol

CH4O

结构：N#Cc1ncc(N=C=S)cc1C(F)(F)F
HCID25019980

未命名化合物

结构：CNC(=O)c1ccc(NC2(C#N)CCC2)cc1F
HCID44139520

4-[(1-Cyanocyclobutyl)amino]-2-fluoro-N-methylbenzamide

C13H14FN3O

PRODUCTS

生成物

1
结构：CNC(=O)c1ccc(N2C(=S)N(c3cnc(C#N)c(C(F)(F)F)c3)C(=O)C23CCC3)cc1F
HCID24872560

ARN-509

C21H15F4N5O2S

收率 35%

AUXILIARIES

试剂、催化剂与溶剂

1
结构：CN(C)C=O
溶剂HCID6228

N,N-Dimethylformamide

C3H7NO

CONDITIONS

反应条件

温度
80 °C

PROCEDURE

实验过程

5-isothiocyanato-3-(trifluoromethyl)pyridine-2-carbonitrile, 9, A is reacted with 4-(1-cyanocyclobutylamino)-2-fluoro-N-methylbenzamide B in DMF solution by heating in a microwave at 80° C. for 20 hours. Methanol and hydrochloric acid are then added and the reaction allowed to proceed for 2 hours to produce 4-(7-(6-cyano-5-(trifluoromethyl)pyridin-3-yl)-8-oxo-6-thioxo-5,7-diazaspiro[3.4]octan-5-yl)-2-fluoro-N-methylbenzamide, A52 (yield 35 to 87%).