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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > alcohol > tertiary alcohol > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > tertiary alcohol > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > alcohol > tertiary alcohol > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
organic aromatic compound > aromatic ether > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > pyridines > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
organic heterocyclic compound > organonitrogen heterocyclic compound > pyridines > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
organic heterocyclic compound > organic heteromonocyclic compound > pyridines > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > cyanides > nitrile > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
organofluorine compound > fluorobenzenes > difluorobenzene > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > azole > triazoles > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
... > organic heterocyclic compound > organonitrogen heterocyclic compound > azole > triazoles > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
... > organic aromatic compound > heteroarene > monocyclic heteroarene > azole > triazoles > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
... > organic heterocyclic compound > heteroarene > monocyclic heteroarene > azole > triazoles > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > thiocarbonyl compound > thioureas > 4-(/{6-[2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1h-1,2,4-triazol-1-yl)propyl]pyridin-3-yl/}oxy)benzonitrile > (s)-fluoxytioconazole (thione)

Preferred term

(s)-fluoxytioconazole (thione)  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C23H15F4N5O2S

inchi

  • InChI=1S/C23H15F4N5O2S/c24-15-3-7-18(19(25)9-15)22(33,12-32-21(35)30-13-31-32)23(26,27)20-8-6-17(11-29-20)34-16-4-1-14(10-28)2-5-16/h1-9,11,13,33H,12H2,(H,30,31,35)/t22-/m1/s1

inchikey

  • KZOZKFJGERLOJN-JOCHJYFZSA-N

is_enantiomer_of

is_tautomer_of

mass

  • 501.460

monoisotopicmass

  • 501.08826

smiles

  • O[C@](CN1NC=NC1=S)(C1=CC=C(F)C=C1F)C(F)(F)C1=CC=C(OC2=CC=C(C=C2)C#N)C=N1

subset

  • 3_STAR

synonym EXACT

  • 4-({6-[(2S)-2-(2,4-difluorophenyl)-1,1-difluoro-2-hydroxy-3-(5-sulfanylidene-2,5-dihydro-1H-1,2,4-triazol-1-yl)propyl]pyridin-3-yl}oxy)benzonitrile

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:193118

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