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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H35N3O5S
Molecular Weight 525.66
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of THIAZOL-5-YLMETHYL (1S,2S,4S)-1-BENZYL-2-HYDROXY-4-(((2-METHYLPROPOXY)CARBONYL)AMINO)-5-PHENYLPENTYL)CARBAMATE

SMILES

CC(C)COC(=O)N[C@H](C[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CN=CS2)CC3=CC=CC=C3

InChI

InChIKey=NICGAXZYHBZOSD-RNXOBYDBSA-N
InChI=1S/C28H35N3O5S/c1-20(2)17-35-27(33)30-23(13-21-9-5-3-6-10-21)15-26(32)25(14-22-11-7-4-8-12-22)31-28(34)36-18-24-16-29-19-37-24/h3-12,16,19-20,23,25-26,32H,13-15,17-18H2,1-2H3,(H,30,33)(H,31,34)/t23-,25-,26-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H35N3O5S
Molecular Weight 525.66
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 Sun Dec 18 00:11:46 UTC 2022
Edited
by admin
on Sun Dec 18 00:11:46 UTC 2022
Record UNII
D5411SHX82
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
THIAZOL-5-YLMETHYL (1S,2S,4S)-1-BENZYL-2-HYDROXY-4-(((2-METHYLPROPOXY)CARBONYL)AMINO)-5-PHENYLPENTYL)CARBAMATE
Common Name English
RITONAVIR IMPURITY K [EP IMPURITY]
Common Name English
RITONAVIR IMPURITY, ISOBUTOXYCARBONYL AMINOALCOHOL- [USP IMPURITY]
Common Name English
CARBAMIC ACID, N-((1S,2S,4S)-2-HYDROXY-4-(((2-METHYLPROPOXY)CARBONYL)AMINO)-5-PHENYL-1-(PHENYLMETHYL)PENTYL)-, 5-THIAZOLYLMETHYL ESTER
Systematic Name English
ISOBUTYL N-((1S,3S,4S)-1-BENZYL-3-HYDROXY-5-PHENYL-4-(((1,3-THIAZOL-5-YLMETHOXY)CARBONYL)AMINO)PENTYL)CARBAMATE
Systematic Name English
Code System Code Type Description
CAS
1010809-39-8
Created by admin on Sun Dec 18 00:11:46 UTC 2022 , Edited by admin on Sun Dec 18 00:11:46 UTC 2022
PRIMARY
FDA UNII
D5411SHX82
Created by admin on Sun Dec 18 00:11:46 UTC 2022 , Edited by admin on Sun Dec 18 00:11:46 UTC 2022
PRIMARY
PUBCHEM
72941970
Created by admin on Sun Dec 18 00:11:46 UTC 2022 , Edited by admin on Sun Dec 18 00:11:46 UTC 2022
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
UNSPECIFIED
EP