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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > 1-(4-fluorophenyl)-3-[[2-(4-methylphenyl)-1,3-dioxo-7,7a-dihydro-3ah-octahydro-1h-4,7-epoxyisoindol-4-yl]methyl]thiourea
organooxygen compound > 1-(4-fluorophenyl)-3-[[2-(4-methylphenyl)-1,3-dioxo-7,7a-dihydro-3ah-octahydro-1h-4,7-epoxyisoindol-4-yl]methyl]thiourea

Preferred term

1-(4-fluorophenyl)-3-[[2-(4-methylphenyl)-1,3-dioxo-7,7a-dihydro-3ah-octahydro-1h-4,7-epoxyisoindol-4-yl]methyl]thiourea  

Type

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

charge

  • 0

formula

  • C23H20FN3O3S

has_functional_parent

inchi

  • InChI=1S/C23H20FN3O3S/c1-13-2-8-16(9-3-13)27-20(28)18-17-10-11-23(30-17,19(18)21(27)29)12-25-22(31)26-15-6-4-14(24)5-7-15/h2-11,17-19H,12H2,1H3,(H2,25,26,31)

inchikey

  • ACFCHHALVAZPES-UHFFFAOYSA-N

mass

  • 437.489

monoisotopicmass

  • 437.12094

smiles

  • CC1=CC=C(C=C1)N2C(=O)C3C4C=CC(C3C2=O)(O4)CNC(=S)NC5=CC=C(C=C5)F

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:107254

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