HRID573837

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID90412442

未命名化合物

结构：O=C=NCCc1ccc(-c2ncn(-c3ccc(C(F)(F)F)cc3)n2)cc1.[N-]=[N+]=NC(=O)CCc1ccc(-c2ncn(-c3ccc(C(F)(F)F)cc3)n2)cc1

HCID131732837

未命名化合物

PRODUCTS

生成物

$结构：CC(C)c1ccc(Cl)cc1N1C(=O)CS/C1=N\C(=O)NCCc1ccc(-c2ncn(-c3ccc(C(F)(F)F)cc3)n2)cc1$

HCID90411950

未命名化合物

PROCEDURE

实验过程

The title compound was prepared as described in Example 35 using 3-(4-(1-(4-(trifluoromethyl)phenyl)-1H-1,2,4-triazol-3-yl)phenyl)propanoyl azide/3-(4-(2-isocyanatoethyl)phenyl)-1-(4-(trifluoromethyl)phenyl)-1H-1,2,4-triazole (C35b) and 1-(5-chloro-2-isopropylphenyl)thiourea (CB32) at a temperature of 60° C.; isolated as a clear oil (0.019 g, 12%).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ad0c4dd0e10745c4af95cb252dd6992d
来源数据集: uspto-grants-2015_05
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09029560B2
来源说明: uspto-grants-2015_05

反应 SMILES

FC(F)(F)C1C=CC(N2C=NC(C3C=CC(C[CH2:21][C:22](N=[N+]=[N-])=[O:23])=CC=3)=N2)=CC=1.[N:29]([CH2:32][CH2:33][C:34]1[CH:39]=[CH:38][C:37]([C:40]2[N:44]=[CH:43][N:42]([C:45]3[CH:50]=[CH:49][C:48]([C:51]([F:54])([F:53])[F:52])=[CH:47][CH:46]=3)[N:41]=2)=[CH:36][CH:35]=1)=[C:30]=[O:31].[Cl:55][C:56]1[CH:57]=[CH:58][C:59]([CH:66]([CH3:68])[CH3:67])=[C:60]([NH:62][C:63]([NH2:65])=[S:64])[CH:61]=1>>[Cl:55][C:56]1[CH:57]=[CH:58][C:59]([CH:66]([CH3:68])[CH3:67])=[C:60]([N:62]2[C:22](=[O:23])[CH2:21][S:64]/[C:63]/2=[N:65]\[C:30]([NH:29][CH2:32][CH2:33][C:34]2[CH:39]=[CH:38][C:37]([C:40]3[N:44]=[CH:43][N:42]([C:45]4[CH:50]=[CH:49][C:48]([C:51]([F:54])([F:53])[F:52])=[CH:47][CH:46]=4)[N:41]=3)=[CH:36][CH:35]=2)=[O:31])[CH:61]=1