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Substance Name: A-98498
RN: 176655-55-3
UNII: 34F916N28Z
InChIKey: IQKWCORIMSRQGZ-AMEOFWRWSA-N

Molecular Formula

  • C32-H45-N5-O3-S

Molecular Weight

  • 579.8055
 
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Names and Synonyms

Name of Substance

  • A-98498

Synonyms

  • (2S)-N-((1S,3S,4S)-4-Amino-1-benzyl-3-hydroxy-5-phenyl-pentyl)-2-(((2-isopropylthiazol-4-yl)methyl-methyl-carbamoyl)amino)-3-methyl-butanamide
  • A-98498
  • Butanamide, N-((1S,3S,4S)-4-amino-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl)-3-methyl-2-(((methyl((2-(1-methylethyl)-4-thiazolyl)methyl)amino)carbonyl)amino)-, (2S)-
  • Butanamide, N-(4-amino-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl)-3-methyl-2-(((methyl((2-(1-methylethyl)-4-thiazolyl)methyl)amino)carbonyl)amino)-, (1S-(1R*(R*),3R*,4R*))-
  • Ritonavir metabolite M1
  • UNII-34F916N28Z

Registry Numbers

CAS Registry Number

  • 176655-55-3

FDA UNII

  • 34F916N28Z

System Generated Number

  • 0176655553

Structure Descriptors

InChI

1S/C32H45N5O3S/c1-21(2)29(36-32(40)37(5)19-26-20-41-31(35-26)22(3)4)30(39)34-25(16-23-12-8-6-9-13-23)18-28(38)27(33)17-24-14-10-7-11-15-24/h6-15,20-22,25,27-29,38H,16-19,33H2,1-5H3,(H,34,39)(H,36,40)/t25-,27-,28-,29-/m0/s1

InChIKey

IQKWCORIMSRQGZ-AMEOFWRWSA-N

Smiles

CC(C)c1nc(cs1)CN(C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc2ccccc2)C[C@@H]([C@H](Cc3ccccc3)N)O