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Details

Stereochemistry ACHIRAL
Molecular Formula C16H11BrClFN4O4
Molecular Weight 457.638
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-((6-(4-BROMO-2-CHLORO-ANILINO)-7-FLUORO-3H-BENZIMIDAZOLE-5-CARBONYL)AMINO)OXYACETIC ACID

SMILES

OC(=O)CONC(=O)C1=C(NC2=CC=C(Br)C=C2Cl)C(F)=C3N=CNC3=C1

InChI

InChIKey=XVIMSMBERLICDM-UHFFFAOYSA-N
InChI=1S/C16H11BrClFN4O4/c17-7-1-2-10(9(18)3-7)22-14-8(16(26)23-27-5-12(24)25)4-11-15(13(14)19)21-6-20-11/h1-4,6,22H,5H2,(H,20,21)(H,23,26)(H,24,25)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
2-((6-(4-BROMO-2-CHLORO-ANILINO)-7-FLUORO-3H-BENZIMIDAZOLE-5-CARBONYL)AMINO)OXYACETIC ACID
Systematic Name English
SELUMETINIB METABOLITE M11
Common Name English
N-DEMETHYL SELUMETINIB CARBOXYLIC ACID, (OXIDATION OF ALCOHOL)-
Common Name English
Code System Code Type Description
FDA UNII
6HN5V887FC
Created by admin on Sat Dec 16 15:20:06 GMT 2023 , Edited by admin on Sat Dec 16 15:20:06 GMT 2023
PRIMARY
PUBCHEM
155804676
Created by admin on Sat Dec 16 15:20:06 GMT 2023 , Edited by admin on Sat Dec 16 15:20:06 GMT 2023
PRIMARY PUBCHEM
PARENT (METABOLITE)
Structure of SELUMETINIB
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