(2S,2'S)-N,N'-((2S,3S,5S)-3-HYDROXY-1,6-DIPHENYLHEXANE-2,5-DIYL)BIS(2-(3-((2-ISOPROPYLTHIAZOL-4-YL)METHYL)-3-METHYLUREIDO(-3-METHYLBUTANAMIDE)

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C46H66N8O5S2
Molecular Weight	875.197
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (2S,2'S)-N,N'-((2S,3S,5S)-3-HYDROXY-1,6-DIPHENYLHEXANE-2,5-DIYL)BIS(2-(3-((2-ISOPROPYLTHIAZOL-4-YL)METHYL)-3-METHYLUREIDO(-3-METHYLBUTANAMIDE)

Structure Search

SMILES

CC(C)[C@H](NC(=O)N(C)CC1=CSC(=N1)C(C)C)C(=O)N[C@H](C[C@H](O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC(=O)N(C)CC3=CSC(=N3)C(C)C)C(C)C)CC4=CC=CC=C4

InChI

InChIKey=YOFGDVVGZPWCGY-JEXMNKNPSA-N

InChI=1S/C46H66N8O5S2/c1-28(2)39(51-45(58)53(9)24-35-26-60-43(48-35)30(5)6)41(56)47-34(21-32-17-13-11-14-18-32)23-38(55)37(22-33-19-15-12-16-20-33)50-42(57)40(29(3)4)52-46(59)54(10)25-36-27-61-44(49-36)31(7)8/h11-20,26-31,34,37-40,55H,21-25H2,1-10H3,(H,47,56)(H,50,57)(H,51,58)(H,52,59)/t34-,37-,38-,39-,40-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C46H66N8O5S2
Molecular Weight	875.197
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:36:34 GMT 2025` Edited by `admin` on `Mon Mar 31 23:36:34 GMT 2025`
Record UNII	42DVW90Y6N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RITONAVIR IMPURITY T [EP IMPURITY]

Preferred Name

English

(2S,2'S)-N,N'-((2S,3S,5S)-3-HYDROXY-1,6-DIPHENYLHEXANE-2,5-DIYL)BIS(2-(3-((2-ISOPROPYLTHIAZOL-4-YL)METHYL)-3-METHYLUREIDO(-3-METHYLBUTANAMIDE)

Common Name

English

(2S)-N-((1S,2S,4S)-1-BENZYL-2-HYDROXY-4-(((2S)-3-METHYL-2-((METHYL((2-(1-METHYLETHYL)THIAZOL-4-YL)METHYL)CARBAMOYL)AMINO)BUTANOYL)AMINO)-5-PHENYLPENTYL)-3-METHYL-2-((METHYL((2-(1-METHYLETHYL)THIAZOL-4-YL)METHYL)CARBAMOYL)AMINO)BUTANAMIDE

Systematic Name

English

2,5,10,13-TETRAAZATETRADECANEDIAMIDE, 7-HYDROXY-N1,N14-DIMETHYL-3,12-BIS(1-METHYLETHYL)-N1,N14-BIS((2-(1-METHYLETHYL)-4-THIAZOLYL)METHYL)-4,11-DIOXO-6,9-BIS(PHENYLMETHYL)-, (3S,6S,7S,9S,12S)-

Systematic Name

English

RITONAVIR IMPURITY, DIVALINYL ANALOGR- [USP IMPURITY]

Common Name

English

Code System Code Type Description

PUBCHEM

11707763

Created by admin on Mon Mar 31 23:36:34 GMT 2025 , Edited by admin on Mon Mar 31 23:36:34 GMT 2025

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FDA UNII

42DVW90Y6N

Created by admin on Mon Mar 31 23:36:34 GMT 2025 , Edited by admin on Mon Mar 31 23:36:34 GMT 2025

PRIMARY

CAS

869368-48-9

Created by admin on Mon Mar 31 23:36:34 GMT 2025 , Edited by admin on Mon Mar 31 23:36:34 GMT 2025

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