Chem
J-GLOBAL ID:200907000971594918   Nikkaji number:J596.702C

1,1′-[Methylenebis(4,1-phenylene)]bis[3-[pentafluorothio(VI)]urea]

1,1′-[メチレンビス(4,1-フェニレン)]ビス[3-[ペンタフルオロチオ(VI)]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: C15H14F10N4O2S2
Molecular formula furigana: C15-H14-F10-N4-O2-S2
Molecular weight: 536.410
InChI: InChI=1S/C15H14F10N4O2S2/c16-32(17,18,19,20)28-14(30)26-12-5-1-10(2-6-12)9-11-3-7-13(8-4-11)27-15(31)29-33(21,22,23,24)25/h1-8H,9H2,(H2,26,28,30)(H2,27,29,31)
InChI key: VHZFCGYHBSPKJW-UHFFFAOYSA-N
SMILES: FS(F)(F)(F)(F)NC(=O)Nc1ccc(Cc2ccc(NC(=O)NS(F)(F)(F)(F)F)cc2)cc1
Systematic name  (3):
  • 1,1′-[メチレンビス(4,1-フェニレン)]ビス[3-[ペンタフルオロチオ(VI)]尿素]
  • 3-(ペンタフルオロ-λ6-スルファニル)-1-{4-[(4-{[(ペンタフルオロ-λ6-スルファニル)カルバモイル]アミノ}フェニル)メチル]フェニル}尿素
  • 3-(pentafluoro-λ6-sulfanyl)-1-{4-[(4-{[(pentafluoro-λ6-sulfanyl)carbamoyl]amino}phenyl)methyl]phenyl}urea
Other name (1):
  • 1,1′-[Methylenebis(4,1-phenylene)]bis[3-[pentafluorothio(VI)]urea]
CAS registry number: 90598-06-4
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