(.ALPHA.S)-.ALPHA.-(((2,5-DIHYDRO-5-OXO-1H-1,2,4-TRIAZOL-3-YL)METHYL)AMINO)-4-FLUOROBENZENEACETIC ACID

OC(=O)[C@@H](NCC1=NC(=O)NN1)C2=CC=C(F)C=C2

InChIKey=QSRDUFZLMUXSIX-VIFPVBQESA-N

InChI=1S/C11H11FN4O3/c12-7-3-1-6(2-4-7)9(10(17)18)13-5-8-14-11(19)16-15-8/h1-4,9,13H,5H2,(H,17,18)(H2,14,15,16,19)/t9-/m0/s1

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

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:13:27 GMT 2023` Edited by `admin` on `Sat Dec 16 15:13:27 GMT 2023`
Record UNII	UQA9Y9TN3T
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

(.ALPHA.S)-.ALPHA.-(((2,5-DIHYDRO-5-OXO-1H-1,2,4-TRIAZOL-3-YL)METHYL)AMINO)-4-FLUOROBENZENEACETIC ACID

Systematic Name

English

APREPITANT METABOLITE M-4

Common Name

English

BENZENEACETIC ACID, .ALPHA.-(((2,5-DIHYDRO-5-OXO-1H-1,2,4-TRIAZOL-3-YL)METHYL)AMINO)-4-FLUORO-, (.ALPHA.S)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

156028084

Created by admin on Sat Dec 16 15:13:27 GMT 2023 , Edited by admin on Sat Dec 16 15:13:27 GMT 2023

PRIMARY

FDA UNII

UQA9Y9TN3T

Created by admin on Sat Dec 16 15:13:27 GMT 2023 , Edited by admin on Sat Dec 16 15:13:27 GMT 2023

PRIMARY

CAS

419574-36-0

Created by admin on Sat Dec 16 15:13:27 GMT 2023 , Edited by admin on Sat Dec 16 15:13:27 GMT 2023

PRIMARY

Related Record Type Details


					1NF15YR6UY

PARENT -> METABOLITE

Amount: