Chemical Compound

Atazanavir sulfate

CAS Registry Number 229975-97-7
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Atazanavir sulfate chemical structure
Primary Record

Atazanavir sulfate

In stock
9,581 g
Purity
99.4 %
CAS
229975-97-7

Compound Identifiers & Properties

CAS
229975-97-7
PubChem CID
138393802
SMILES
CC(C)(C)[C@H](C(=O)NC(CC1=CC=CC=C1)[C@@H](CN(CC2=CC=C(C=C2)C3=CC=CC=N3)NC(=O)[C@@H](C(C)(C)C)NC(=O)OC)O)NC(=O)OC.OS(=O)(=O)O
Canonical SMILES
COC(=O)N[C@@H](C(=O)NC(Cc1ccccc1)[C@H](O)CN(Cc1ccc(-c2ccccn2)cc1)NC(=O)[C@H](NC(=O)OC)C(C)(C)C)C(C)(C)C.O=S(=O)(O)O

Names & Synonyms

  • Atazanavir sulfate
  • C38H54N6O11S
  • MFCD08067748
  • 229975-97-7
  • methyl N-[(1R)-1-[[(2R)-1-benzyl-2-hydroxy-3-[[[(2R)-2-(methoxycarbonylamino)-3,3-dimethyl-butanoyl]amino]-[[4-(2-pyridyl)phenyl]methyl]amino]propyl]carbamoyl]-2,2-dimethyl-propyl]carbamate;sulfuric acid