Chem
J-GLOBAL ID：200907023583460640   Nikkaji number：J1.268.981K

PETT-2

1-(5-クロロ-2-ピリジニル)-3-[2-(3-フルオロ-4-エトキシ-2-ピリジニル)エチル]チオ尿素
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： C15H16ClFN4OS
Molecular formula furigana： C15-H16-CL-F-N4-O-S
Molecular weight： 354.830
InChI： InChI=1S/C15H16ClFN4OS/c1-2-22-12-6-8-18-11(14(12)17)5-7-19-15(23)21-13-4-3-10(16)9-20-13/h3-4,6,8-9H,2,5,7H2,1H3,(H2,19,20,21,23)
InChI key： VEBKSFPYWMOUBR-UHFFFAOYSA-N
SMILES： CCOc1ccnc(CCNC(=S)Nc2ccc(Cl)cn2)c1F
Systematic name  (4)：
  • 1-(5-クロロピリジン-2-イル)-3-[2-(3-フルオロ-4-エトキシピリジン-2-イル)エチル]チオ尿素
  • 1-(5-クロロ-2-ピリジニル)-3-[2-(3-フルオロ-4-エトキシ-2-ピリジニル)エチル]チオ尿素
  • 1-(5-クロロピリジン-2-イル)-3-[2-(4-エトキシ-3-フルオロピリジン-2-イル)エチル]チオ尿素
  • 1-(5-chloropyridin-2-yl)-3-[2-(4-ethoxy-3-fluoropyridin-2-yl)ethyl]thiourea
Other name (3)：
  • 1-(5-Chloropyridine-2-yl)-3-[2-(3-fluoro-4-ethoxypyridine-2-yl)ethyl]thiourea
  • 1-(5-Chloro-2-pyridinyl)-3-[2-(3-fluoro-4-ethoxy-2-pyridinyl)ethyl]thiourea
  • PETT-2
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