Chem
J-GLOBAL ID：201807001491984135   Nikkaji number：J3.723.207F

1-[3-[3-(Trifluoromethyl)-3H-diazirine-3-yl]phenyl]thiourea

{3-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]フェニル}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： C9H7F3N4S
Molecular formula furigana： C9-H7-F3-N4-S
Molecular weight： 260.240
InChI： InChI=1S/C9H7F3N4S/c10-9(11,12)8(15-16-8)5-2-1-3-6(4-5)14-7(13)17/h1-4H,(H3,13,14,17)
InChI key： MPVBKHRHQRRGIM-UHFFFAOYSA-N
SMILES： NC(=S)Nc1cccc(c1)C1(N=N1)C(F)(F)F
Systematic name  (3)：
  • 1-[3-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]フェニル]チオ尿素
  • {3-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]フェニル}チオ尿素
  • {3-[3-(trifluoromethyl)-3H-diazirin-3-yl]phenyl}thiourea
Other name (1)：
  • 1-[3-[3-(Trifluoromethyl)-3H-diazirine-3-yl]phenyl]thiourea
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