JE-2178

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H51N5O6S
Molecular Weight	669.874
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)[C@H](NC(=O)COC1=CC=CC(=C1)N(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)[C@H](O)C(=O)N3CSC(C)(C)[C@H]3C(=O)NC(C)(C)C

InChI

InChIKey=FLGSEMHTCIIOEU-ZVVXMFRTSA-N

InChI=1S/C35H51N5O6S/c1-22(2)28(37-27(41)20-46-25-17-13-16-24(19-25)39(8)9)31(43)36-26(18-23-14-11-10-12-15-23)29(42)33(45)40-21-47-35(6,7)30(40)32(44)38-34(3,4)5/h10-17,19,22,26,28-30,42H,18,20-21H2,1-9H3,(H,36,43)(H,37,41)(H,38,44)/t26-,28-,29-,30+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C35H51N5O6S
Molecular Weight	669.874
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
Structure-activity relationship of orally potent tripeptide-based HIV protease inhibitors containing hydroxymethylcarbonyl isostere.	2000-09	10993230

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:50:45 GMT 2025` Edited by `admin` on `Mon Mar 31 22:50:45 GMT 2025`
Record UNII	JDK4UN3PE7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

JE-2178

Common Name

English

4-THIAZOLIDINECARBOXAMIDE, 3-((2S,3S)-3-(((2S)-2-((2-(3-(DIMETHYLAMINO)PHENOXY)ACETYL)AMINO)-3-METHYL-1-OXOBUTYL)AMINO)-2-HYDROXY-1-OXO-4-PHENYLBUTYL)-N-(1,1-DIMETHYLETHYL)-5,5-DIMETHYL-, (4R)-

Preferred Name

English

Code System Code Type Description

FDA UNII

JDK4UN3PE7

Created by admin on Mon Mar 31 22:50:45 GMT 2025 , Edited by admin on Mon Mar 31 22:50:45 GMT 2025

PRIMARY

PUBCHEM

481575

Created by admin on Mon Mar 31 22:50:45 GMT 2025 , Edited by admin on Mon Mar 31 22:50:45 GMT 2025

PRIMARY

CAS

210181-19-4

Created by admin on Mon Mar 31 22:50:45 GMT 2025 , Edited by admin on Mon Mar 31 22:50:45 GMT 2025

PRIMARY

Related Record Type Details


					JDK4UN3PE7

JE-2178

ACTIVE MOIETY