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Concept information

Preferred term

1-[(2s,3s,6s)-6-[2-[4-(4-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]-3-propan-2-ylurea  

Type

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

Broader concept

charge

  • 0

formula

  • C20H28FN5O3

inchi

  • InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17-,19+/m0/s1

inchikey

  • IVGXTVZUVQFGHY-JENIJYKNSA-N

mass

  • 405.467

monoisotopicmass

  • 405.21762

smiles

  • CC(C)NC(=O)N[C@H]1CC[C@H](O[C@@H]1CO)CCN2C=C(N=N2)C3=CC=C(C=C3)F

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:120108

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