HRID1402011

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2769411

未命名化合物

结构：COc1ccc(CN(c2ncns2)S(=O)(=O)c2ccc(F)c(C#N)c2)c(OC)c1

HCID58042254

3-Cyano-N-[(2,4-dimethoxyphenyl)methyl]-4-fluoro-N-1,2,4-thiadiazol-5-ylbenzenesulfonamide

C18H15FN4O4S2

PRODUCTS

生成物

结构：COc1ccc(CN(c2ncns2)S(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3I)c(C#N)c2)c(OC)c1

HCID66905795

3-Cyano-N-[(2,4-dimethoxyphenyl)methyl]-4-[2-iodo-4-(trifluoromethoxy)phenoxy]-N-1,2,4-thiadiazol-5-ylbenzenesulfonamide

C25H18F3IN4O6S2

PROCEDURE

实验过程

The title compound was prepared according to Preparation 255 using 2-iodo-4-(trifluoromethoxy)phenol (Preparation 226) and 3-cyano-N-(2,4-dimethoxybenzyl)-4-fluoro-N-1,2,4-thiadiazol-5-ylbenzene sulfonamide (Preparation 68).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9d4cffacbb2042a68150293c38546c40
来源数据集: uspto-grants-2014_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08907101B2
来源说明: uspto-grants-2014_12

反应 SMILES

[I:1][C:2]1[CH:7]=[C:6]([O:8][C:9]([F:12])([F:11])[F:10])[CH:5]=[CH:4][C:3]=1[OH:13].[C:14]([C:16]1[CH:17]=[C:18]([S:23]([N:26]([CH2:32][C:33]2[CH:38]=[CH:37][C:36]([O:39][CH3:40])=[CH:35][C:34]=2[O:41][CH3:42])[C:27]2[S:31][N:30]=[CH:29][N:28]=2)(=[O:25])=[O:24])[CH:19]=[CH:20][C:21]=1F)#[N:15]>>[C:14]([C:16]1[CH:17]=[C:18]([S:23]([N:26]([CH2:32][C:33]2[CH:38]=[CH:37][C:36]([O:39][CH3:40])=[CH:35][C:34]=2[O:41][CH3:42])[C:27]2[S:31][N:30]=[CH:29][N:28]=2)(=[O:25])=[O:24])[CH:19]=[CH:20][C:21]=1[O:13][C:3]1[CH:4]=[CH:5][C:6]([O:8][C:9]([F:11])([F:12])[F:10])=[CH:7][C:2]=1[I:1])#[N:15]