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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > ureas > 2-[(2r,3s,6r)-3-[[(2,5-difluoroanilino)-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2h-pyran-6-yl]-n-(4-pyrimidinylmethyl)acetamide

Preferred term

2-[(2r,3s,6r)-3-[[(2,5-difluoroanilino)-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2h-pyran-6-yl]-n-(4-pyrimidinylmethyl)acetamide  

Type

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

Broader concept

charge

  • 0

formula

  • C20H21F2N5O4

inchi

  • InChI=1S/C20H21F2N5O4/c21-12-1-3-15(22)17(7-12)27-20(30)26-16-4-2-14(31-18(16)10-28)8-19(29)24-9-13-5-6-23-11-25-13/h1-7,11,14,16,18,28H,8-10H2,(H,24,29)(H2,26,27,30)/t14-,16-,18-/m0/s1

inchikey

  • MOYKFZGAGJCWIL-ZVZYQTTQSA-N

mass

  • 433.409

monoisotopicmass

  • 433.15616

smiles

  • C1=C[C@@H]([C@@H](O[C@@H]1CC(=O)NCC2=NC=NC=C2)CO)NC(=O)NC3=C(C=CC(=C3)F)F

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:124250

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