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Details

Stereochemistry ACHIRAL
Molecular Formula C17H13ClN4O3
Molecular Weight 356.763
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(4-(3-CHLORO-4-HYDROXY-ANILINO)-2-HYDROXY-QUINAZOLIN-6-YL)PROP-2-ENAMIDE

SMILES

OC1=CC=C(NC2=C3C=C(NC(=O)C=C)C=CC3=NC(O)=N2)C=C1Cl

InChI

InChIKey=NTONYLOFYMMWQZ-UHFFFAOYSA-N
InChI=1S/C17H13ClN4O3/c1-2-15(24)19-9-3-5-13-11(7-9)16(22-17(25)21-13)20-10-4-6-14(23)12(18)8-10/h2-8,23H,1H2,(H,19,24)(H2,20,21,22,25)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
N-(4-(3-CHLORO-4-HYDROXY-ANILINO)-2-HYDROXY-QUINAZOLIN-6-YL)PROP-2-ENAMIDE
Systematic Name English
ALLITINIB METABOLITE M3
Common Name English
Code System Code Type Description
PUBCHEM
156596580
Created by admin on Sat Dec 16 16:53:55 GMT 2023 , Edited by admin on Sat Dec 16 16:53:55 GMT 2023
PRIMARY
FDA UNII
ML53E2JU8G
Created by admin on Sat Dec 16 16:53:55 GMT 2023 , Edited by admin on Sat Dec 16 16:53:55 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of ALLITINIB
NIH
NCATS
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