HRID53395

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CCSC1=CCC(C)(C)c2ccc(C#Cc3ccc(C(=O)O)cc3)cc21

HCID19962312

未命名化合物

结构：CCOC(=O)c1ccc(C#Cc2ccc3c(c2)C(S(=O)(=O)CC)=CCC3(C)C)cc1

HCID19962313

未命名化合物

结构：CCOC(=O)c1ccc(C#Cc2ccc3c(c2)C(Sc2ccccc2)=CCC3(C)C)cc1

HCID19962320

未命名化合物

2 次

PRODUCTS

生成物

结构：CC1(C)CC=C(Sc2ccccc2)c2cc(C#Cc3ccc(C(=O)O)cc3)ccc21

HCID19962314

未命名化合物

PROCEDURE

实验过程

Employing the same general procedure as for the preparation of 4-[(7,8-dihydro-8,8-dimethyl-5-ethylthionaphth-3-yl)ethynyl]benzoic acid (Compound 153), 100 mg (0.38 mmol) of ethyl 4-[(7,8-dihydro-8,8-dimethyl-5-phenylthionaphth-3-yl)ethynyl]benzoate (Compound 155) was converted into the title compound (white solid, recrystallized from acetonitrile) using 2 ml of KOH (2N aqueous solution).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4c7d3697045b4fb4b1b262c95d9f48a3
来源数据集: uspto-grants-1997_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05618931
来源说明: uspto-grants-1997_04

反应 SMILES

CC1(C)C2C=CC(C#CC3C=CC(C(O)=O)=CC=3)=CC=2C(SCC)=CC1.CC1(C)C2C=CC(C#CC3C=CC(C(OCC)=O)=CC=3)=CC=2C(S(CC)(=O)=O)=CC1.[CH3:57][C:58]1([CH3:88])[C:67]2[CH:66]=[CH:65][C:64]([C:68]#[C:69][C:70]3[CH:80]=[CH:79][C:73]([C:74]([O:76]CC)=[O:75])=[CH:72][CH:71]=3)=[CH:63][C:62]=2[C:61]([S:81][C:82]2[CH:87]=[CH:86][CH:85]=[CH:84][CH:83]=2)=[CH:60][CH2:59]1>>[CH3:57][C:58]1([CH3:88])[C:67]2[CH:66]=[CH:65][C:64]([C:68]#[C:69][C:70]3[CH:80]=[CH:79][C:73]([C:74]([OH:76])=[O:75])=[CH:72][CH:71]=3)=[CH:63][C:62]=2[C:61]([S:81][C:82]2[CH:87]=[CH:86][CH:85]=[CH:84][CH:83]=2)=[CH:60][CH2:59]1