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Details

Stereochemistry ABSOLUTE
Molecular Formula C38H44N2O5
Molecular Weight 608.7678
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TS-97

SMILES

Cc1cccc(C)c1OCC(=N[C@@]([H])(Cc2ccccc2)C[C@@]([H])([C@]([H])(Cc3ccccc3)N=C(COc4c(C)cccc4C)O)O)O

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

Molecular Formula C38H44N2O5
Molecular Weight 608.7678
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 12:29:30 UTC 2021
Edited
by admin
on Sat Jun 26 12:29:30 UTC 2021
Record UNII
6214X5CP9P
Record Status Validated (UNII)
Record Version
  • Download
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, LOPINAVIR DIAMIDE- [USP]
Common Name English
LOPINAVIR SPECIFIED IMPURITY Q [EP]
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
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 Sat Jun 26 12:29:30 UTC 2021 , Edited by admin on Sat Jun 26 12:29:30 UTC 2021
PRIMARY
PUBCHEM
3011315
Created by admin on Sat Jun 26 12:29:30 UTC 2021 , Edited by admin on Sat Jun 26 12:29:30 UTC 2021
PRIMARY
CAS
667904-94-1
Created by admin on Sat Jun 26 12:29:30 UTC 2021 , Edited by admin on Sat Jun 26 12:29:30 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
Amount not specified.