Methyl (S)-5-((4-bromo-2-picolinoylphenyl)amino)-4-((tert-butoxycarbonyl)amino)-5-oxopentanoate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H26BrN3O6
Molecular Weight	520.373
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Methyl (S)-5-((4-bromo-2-picolinoylphenyl)amino)-4-((tert-butoxycarbonyl)amino)-5-oxopentanoate

Structure Search

SMILES

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

InChI

InChIKey=GHRHRLDIDLJJRD-SFHVURJKSA-N

InChI=1S/C23H26BrN3O6/c1-23(2,3)33-22(31)27-18(10-11-19(28)32-4)21(30)26-16-9-8-14(24)13-15(16)20(29)17-7-5-6-12-25-17/h5-9,12-13,18H,10-11H2,1-4H3,(H,26,30)(H,27,31)/t18-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C23H26BrN3O6
Molecular Weight	520.373
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 21:01:18 GMT 2025` Edited by `admin` on `Wed Apr 02 21:01:18 GMT 2025`
Record UNII	H6TVK46AFU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Methyl (4S)-5-[[4-bromo-2-(2-pyridinylcarbonyl)phenyl]amino]-4-[[(1,1-dimethylethoxy)carbonyl]amino]-5-oxopentanoate

Preferred Name

English

Methyl (S)-5-((4-bromo-2-picolinoylphenyl)amino)-4-((tert-butoxycarbonyl)amino)-5-oxopentanoate

Systematic Name

English

Pentanoic acid, 5-[[4-bromo-2-(2-pyridinylcarbonyl)phenyl]amino]-4-[[(1,1-dimethylethoxy)carbonyl]amino]-5-oxo-, methyl ester, (4S)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

51038481

Created by admin on Wed Apr 02 21:01:18 GMT 2025 , Edited by admin on Wed Apr 02 21:01:18 GMT 2025

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CAS

1275616-57-3

Created by admin on Wed Apr 02 21:01:18 GMT 2025 , Edited by admin on Wed Apr 02 21:01:18 GMT 2025

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FDA UNII

H6TVK46AFU

Created by admin on Wed Apr 02 21:01:18 GMT 2025 , Edited by admin on Wed Apr 02 21:01:18 GMT 2025

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