U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C38H44N2O5
Molecular Weight 608.7664
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TS-97

SMILES

CC1=CC=CC(C)=C1OCC(=O)N[C@H](C[C@H](O)[C@H](CC2=CC=CC=C2)NC(=O)COC3=C(C)C=CC=C3C)CC4=CC=CC=C4

InChI

InChIKey=GSGYWFIAIGBFSD-AFEGWXKPSA-N
InChI=1S/C38H44N2O5/c1-26-13-11-14-27(2)37(26)44-24-35(42)39-32(21-30-17-7-5-8-18-30)23-34(41)33(22-31-19-9-6-10-20-31)40-36(43)25-45-38-28(3)15-12-16-29(38)4/h5-20,32-34,41H,21-25H2,1-4H3,(H,39,42)(H,40,43)/t32-,33-,34-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
TS-97
Common Name English
N,N'-((2S,3S,5S)-3-HYDROXY-1,6-DIPHENYLHEXANE-2,5-DIYL)BIS(2-(2,6-DIMETHYLPHENOXY)ACETAMIDE)
Systematic Name English
LOPINAVIR IMPURITY Q [EP IMPURITY]
Common Name English
LOPINAVIR DIAMIDE [WHO-IP]
Common Name English
LOPINAVIR IMPURITY H [WHO-IP]
Common Name English
LOPINAVIR DIAMIDE
WHO-IP  
Common Name English
ACETAMIDE, N,N'-((1S,2S,4S)-2-HYDROXY-1,4-BIS(PHENYLMETHYL)-1,4-BUTANEDIYL)BIS(2-(2,6-DIMETHYLPHENOXY)-
Systematic Name English
LOPINAVIR IMPURITY, LOPINAVIR DIAMIDE- [USP IMPURITY]
Common Name English
N-((1S,2S,4S)-1-BENZYL-4-((2-(2,6-DIMETHYLPHENOXY)ACETYL)AMINO)-2-HYDROXY-5-PHENYLPENTYL)-2-(2,6-DIMETHYLPHENOXY)ACETAMIDE
Systematic Name English
Code System Code Type Description
FDA UNII
6214X5CP9P
Created by admin on Fri Dec 15 16:15:43 GMT 2023 , Edited by admin on Fri Dec 15 16:15:43 GMT 2023
PRIMARY
PUBCHEM
3011315
Created by admin on Fri Dec 15 16:15:43 GMT 2023 , Edited by admin on Fri Dec 15 16:15:43 GMT 2023
PRIMARY
CAS
667904-94-1
Created by admin on Fri Dec 15 16:15:43 GMT 2023 , Edited by admin on Fri Dec 15 16:15:43 GMT 2023
PRIMARY