2-(6-chloro-9-(3-hydroxy-3-methylbut-1-ynyl)-1H-phenanthro[9,10-d]imidazol-2-yl)isophthalonitrile

HCID 178459032

ノート反応

部分構造検索類似構造を探す

基本情報

標準SMILES: CC(C)(O)C#Cc1ccc2c(c1)c1cc(Cl)ccc1c1[nH]c(-c3c(C#N)cccc3C#N)nc21
InChIKey: XHYZCGGTDZPVPB-UHFFFAOYSA-N
分子式: C28H17ClN4O
平均分子量: 460.9 g/mol
単同位体質量: 460.1090889

名称と識別子

優先名称: 2-(6-chloro-9-(3-hydroxy-3-methylbut-1-ynyl)-1H-phenanthro[9,10-d]imidazol-2-yl)isophthalonitrile
IUPAC: 2-[6-chloro-9-(3-hydroxy-3-methylbut-1-ynyl)-1H-phenanthro[9,10-d]imidazol-2-yl]benzene-1,3-dicarbonitrile

名称と別名

CHEMBL483900SCHEMBL1758253SCHEMBL14538260XHYZCGGTDZPVPB-UHFFFAOYSA-NBDBM50271108[9-chloro-6-(3-hydroxy-3-methylbut-1-yn-1-yl)-1H-phenanthro[9,10-d]imidazol-2-yl]isophthalonitrile2-(6-chloro-9-(3-hydroxy-3-methylbut-1-ynyl)-1H-phenanthro[9,10-d]imidazol-2-yl)isophthalonitrile