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Substance Name: Doravirine [USAN:INN]
RN: 1338225-97-0
UNII: 913P6LK81M
InChIKey: ZIAOVIPSKUPPQW-UHFFFAOYSA-N

Note

  • An HIV-1 reverse transcriptase inhibitor.

Classification Code

  • Antiviral

Molecular Formula

  • C17-H11-Cl-F3-N5-O3

Molecular Weight

  • 425.7529
 
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Names and Synonyms

Name of Substance

  • Doravirine [USAN:INN]

Synonyms

  • Benzonitrile, 3-chloro-5-((1-((4,5-dihydro-4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl)-1,2-dihydro-2-oxo-4-(trifluoromethyl)-3-pyridinyl)oxy)-
  • Doravirine
  • MK 1439
  • MK1439
  • UNII-913P6LK81M

Systematic Name

  • 3-Chloro-5-((1-((4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)-2-oxo-4-(trifluoromethyl)-1,2-dihydropyridin-3-yl)oxy)benzonitrile

Registry Numbers

CAS Registry Number

  • 1338225-97-0

FDA UNII

  • 913P6LK81M

System Generated Number

  • 1338225970

Structure Descriptors

InChI

1S/C17H11ClF3N5O3/c1-25-13(23-24-16(25)28)8-26-3-2-12(17(19,20)21)14(15(26)27)29-11-5-9(7-22)4-10(18)6-11/h2-6H,8H2,1H3,(H,24,28)

InChIKey

ZIAOVIPSKUPPQW-UHFFFAOYSA-N

Smiles

Cn1c(n[nH]c1=O)Cn2ccc(c(c2=O)Oc3cc(cc(c3)Cl)C#N)C(F)(F)F