Chem
J-GLOBAL ID：200907096291647330   Nikkaji number：J399.572K

DuP-697

DuP-697
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C17H12BrFO2S2
Molecular formula furigana： C17-H12-BR-F-O2-S2
Molecular weight： 411.300
InChI： InChI=1S/C17H12BrFO2S2/c1-23(20,21)14-8-4-11(5-9-14)15-10-16(18)22-17(15)12-2-6-13(19)7-3-12/h2-10H,1H3
InChI key： AJFTZWGGHJXZOB-UHFFFAOYSA-N
SMILES： CS(=O)(=O)c1ccc(cc1)c1cc(Br)sc1c1ccc(F)cc1
Systematic name  (5)：
  • 2-(4-フルオロフェニル)-3-[4-(メチルスルホニル)フェニル]-5-ブロモチオフェン
  • 5-ブロモ-2-(4-フルオロフェニル)-3-[4-(メチルスルホニル)フェニル]チオフェン
  • 5-ブロモ-2-(4-フルオロフェニル)-3-(4-メチルスルホニルフェニル)チオフェン
  • 5-ブロモ-2-(4-フルオロフェニル)-3-(4-メタンスルホニルフェニル)チオフェン
  • 5-bromo-2-(4-fluorophenyl)-3-(4-methanesulfonylphenyl)thiophene
Other name (4)：
  • 5-Bromo-2-(4-fluorophenyl)-3-[4-(methylsulfonyl)phenyl]thiophene
  • DuP-697
  • 5-Bromo-2-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)thiophene
  • BFMeT
CAS registry number： 88149-94-4
KEGG COMPOUND： C11704
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