Chemical Compound

CHEMBL5865025

CHEMBL5865025 chemical structure
Primary Record

CHEMBL5865025

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
122701707
SMILES
C[C@H](C1=NC=C(C(=N1)[C@@H]2COCCO2)F)[C@H](C)S(=O)(=O)NC3=NN=C(N3C4=C(C=CC=C4OC)OC)C5=NC(=CC=C5)OCC(C(F)(F)F)(C(F)(F)F)O
Canonical SMILES
COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)c([C@@H]3COCCO3)n2)nnc1-c1cccc(OCC(O)(C(F)(F)F)C(F)(F)F)n1

Names & Synonyms

  • CHEMBL5865025
  • SCHEMBL18246151
  • ABUJXGZXWOPYQX-HOIFWPIMSA-N
  • BDBM270073
  • BDBM270074
  • US10058550, Example 639.0
  • US10058550, Example 640.0
  • (2S,3R)-N-(4-(2,6-dimethoxyphenyl)-5-(6-(3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy)-2-pyridinyl)-4H-1,2,4-triazol-3-yl)-3-(4-((2R)-1,4-dioxan-2-yl)-5-fluoro-2-pyrimidinyl)-2-butanesulfonamide, (2S,3R)-N-(4-(2,6-dimethoxyphenyl)-5-(6-(3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propoxy)-2-pyridinyl)-4H-1,2,4-triazol-3-yl)-3-(4-((2S)-1,4-dioxan-2-yl)-5-fluoro-2-pyrimidinyl)-2-butanesulfonamide