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Concept information

Preferred term

1-[(2r,3r,6s)-6-[2-(4-cyclopropyl-1-triazolyl)ethyl]-2-(hydroxymethyl)-3-oxanyl]-3-(2,5-difluorophenyl)urea  

Type

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

Broader concept

charge

  • 0

formula

  • C20H25F2N5O3

inchi

  • InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16+,19-/m0/s1

inchikey

  • HBSXUOUHADHDTK-GMBSWORKSA-N

mass

  • 421.442

monoisotopicmass

  • 421.19255

smiles

  • C1C[C@H]([C@@H](O[C@@H]1CCN2C=C(N=N2)C3CC3)CO)NC(=O)NC4=C(C=CC(=C4)F)F

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:99155

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