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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > triazolopyridine > ethyl 7-benzyl-1-[(4-fluorophenyl)methyl]-5-phenyl-4,6-dihydrotriazolo[4,5-c]pyridine-7-carboxylate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > triazolopyridine > ethyl 7-benzyl-1-[(4-fluorophenyl)methyl]-5-phenyl-4,6-dihydrotriazolo[4,5-c]pyridine-7-carboxylate

Preferred term

ethyl 7-benzyl-1-[(4-fluorophenyl)methyl]-5-phenyl-4,6-dihydrotriazolo[4,5-c]pyridine-7-carboxylate  

Type

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

Broader concept

charge

  • 0

formula

  • C28H27FN4O2

inchi

  • InChI=1S/C28H27FN4O2/c1-2-35-27(34)28(17-21-9-5-3-6-10-21)20-32(24-11-7-4-8-12-24)19-25-26(28)33(31-30-25)18-22-13-15-23(29)16-14-22/h3-16H,2,17-20H2,1H3

inchikey

  • HNPXJDFVFVHUPC-UHFFFAOYSA-N

mass

  • 470.548

monoisotopicmass

  • 470.21180

smiles

  • C(OC(C1(CC=2C=CC=CC2)CN(C=3C=CC=CC3)CC=4N=NN(CC=5C=CC(F)=CC5)C14)=O)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:149952

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