2-(N-(CARBOXYMETHYL)-4-((4-(4-(CYANOMETHYLCARBAMOYL)PHENYL)PYRIMIDIN-2-YL)AMINO)ANILINO)ACETIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H20N6O5
Molecular Weight	460.4421
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(N-(CARBOXYMETHYL)-4-((4-(4-(CYANOMETHYLCARBAMOYL)PHENYL)PYRIMIDIN-2-YL)AMINO)ANILINO)ACETIC ACID

Structure Search

SMILES

OC(=O)CN(CC(O)=O)C1=CC=C(NC2=NC(=CC=N2)C3=CC=C(C=C3)C(=O)NCC#N)C=C1

InChI

InChIKey=WSKQUDSRHSEGSW-UHFFFAOYSA-N

InChI=1S/C23H20N6O5/c24-10-12-25-22(34)16-3-1-15(2-4-16)19-9-11-26-23(28-19)27-17-5-7-18(8-6-17)29(13-20(30)31)14-21(32)33/h1-9,11H,12-14H2,(H,25,34)(H,30,31)(H,32,33)(H,26,27,28)

HIDE SMILES / InChI

Molecular Formula	C23H20N6O5
Molecular Weight	460.4421
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 05:15:39 GMT 2025` Edited by `admin` on `Wed Apr 02 05:15:39 GMT 2025`
Record UNII	6YKA80H48Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-(N-(CARBOXYMETHYL)-4-((4-(4-(CYANOMETHYLCARBAMOYL)PHENYL)PYRIMIDIN-2-YL)AMINO)ANILINO)ACETIC ACID

Systematic Name

English

MOMELOTINIB METABOLITE M5

Preferred Name

English

Code System Code Type Description

PUBCHEM

146019626

Created by admin on Wed Apr 02 05:15:39 GMT 2025 , Edited by admin on Wed Apr 02 05:15:39 GMT 2025

PRIMARY

FDA UNII

6YKA80H48Z

Created by admin on Wed Apr 02 05:15:39 GMT 2025 , Edited by admin on Wed Apr 02 05:15:39 GMT 2025

PRIMARY

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