5-[4-bromo-2-(pyridine-2-carbonyl)anilino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid, (4S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H24BrN3O6
Molecular Weight	506.346
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-[4-bromo-2-(pyridine-2-carbonyl)anilino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid, (4S)-

Structure Search

SMILES

CC(C)(C)OC(=O)N[C@@H](CCC(O)=O)C(=O)NC1=C(C=C(Br)C=C1)C(=O)C2=NC=CC=C2

InChI

InChIKey=QQOUFXSTGWKDGF-KRWDZBQOSA-N

InChI=1S/C22H24BrN3O6/c1-22(2,3)32-21(31)26-17(9-10-18(27)28)20(30)25-15-8-7-13(23)12-14(15)19(29)16-6-4-5-11-24-16/h4-8,11-12,17H,9-10H2,1-3H3,(H,25,30)(H,26,31)(H,27,28)/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H24BrN3O6
Molecular Weight	506.346
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 19:53:08 GMT 2025` Edited by `admin` on `Wed Apr 02 19:53:08 GMT 2025`
Record UNII	U7X52TN3K8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-[4-bromo-2-(pyridine-2-carbonyl)anilino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid, (4S)-

Systematic Name

English

(4S)-5-[4-bromo-2-(pyridine-2-carbonyl)anilino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid

Preferred Name

English

Code System Code Type Description

FDA UNII

U7X52TN3K8

Created by admin on Wed Apr 02 19:53:08 GMT 2025 , Edited by admin on Wed Apr 02 19:53:08 GMT 2025

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PUBCHEM

118501070

Created by admin on Wed Apr 02 19:53:08 GMT 2025 , Edited by admin on Wed Apr 02 19:53:08 GMT 2025

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