HRID1506530

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：C=Cc1ccc2c(c1)CCc1nc(-c3onc(-c4ccccc4)c3C(F)(F)F)sc1-2

HCID67170584

未命名化合物

结构：CCOC(=O)C(CCc1ccc2c(c1)CCc1c-2noc1-c1noc(-c2ccccc2)c1C(F)(F)F)N=C(c1ccccc1)c1ccccc1

HCID86669931

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(CCc1ccc2c(c1)CCc1nc(-c3onc(-c4ccccc4)c3C(F)(F)F)sc1-2)N=C(c1ccccc1)c1ccccc1

HCID86669934

未命名化合物

CONDITIONS

反应条件

温度: 70 °C

PROCEDURE

实验过程

The titled compound was prepared using the experimental protocol described for Preparation 91A employing 3-phenyl-4-(trifluoromethyl)-5-(7-vinyl-4,5-dihydronaphtho[2,1-d]thiazol-2-yl)isoxazole (Preparation 82E) as a starting material. The reaction was heated at 70° C. for 7 hr. The compound had an LC/MS M+1=692.4.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7c834895f8de4128839d1605afaa92cd
来源数据集: uspto-grants-2015_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09216972B2
来源说明: uspto-grants-2015_12

反应 SMILES

[C:1]1([C:7](=[N:14][CH:15]([CH2:21][CH2:22][C:23]2[CH:24]=[C:25]3[C:48](=[CH:49][CH:50]=2)[C:29]2=NOC(C4C(C(F)(F)F)=C(C5C=CC=CC=5)ON=4)=[C:28]2[CH2:27][CH2:26]3)[C:16]([O:18][CH2:19][CH3:20])=[O:17])[C:8]2[CH:13]=[CH:12][CH:11]=[CH:10][CH:9]=2)[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1.[C:51]1([C:57]2[C:61]([C:62]([F:65])([F:64])[F:63])=[C:60]([C:66]3[S:67]C4C5C(=CC(C=C)=CC=5)CCC=4[N:70]=3)[O:59][N:58]=2)[CH:56]=[CH:55][CH:54]=[CH:53][CH:52]=1>>[C:8]1([C:7](=[N:14][CH:15]([CH2:21][CH2:22][C:23]2[CH:24]=[C:25]3[C:48](=[CH:49][CH:50]=2)[C:29]2[S:67][C:66]([C:60]4[O:59][N:58]=[C:57]([C:51]5[CH:56]=[CH:55][CH:54]=[CH:53][CH:52]=5)[C:61]=4[C:62]([F:65])([F:64])[F:63])=[N:70][C:28]=2[CH2:27][CH2:26]3)[C:16]([O:18][CH2:19][CH3:20])=[O:17])[C:1]2[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=2)[CH:13]=[CH:12][CH:11]=[CH:10][CH:9]=1