U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C25H23F3N4O4
Molecular Weight 500.4697
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZETELETINIB

SMILES

COC1=CC2=C(C=C1OC)N=CC(=C2)C3=CC=C(CC(=O)NC4=CC(=NO4)C(C)(C)C(F)(F)F)C=N3

InChI

InChIKey=KOLQINCWMXQEOF-UHFFFAOYSA-N
InChI=1S/C25H23F3N4O4/c1-24(2,25(26,27)28)21-11-23(36-32-21)31-22(33)7-14-5-6-17(29-12-14)16-8-15-9-19(34-3)20(35-4)10-18(15)30-13-16/h5-6,8-13H,7H2,1-4H3,(H,31,33)

HIDE SMILES / InChI

Molecular Formula C25H23F3N4O4
Molecular Weight 500.4697
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 Sat Dec 16 15:13:08 GMT 2023
Edited
by admin
on Sat Dec 16 15:13:08 GMT 2023
Record UNII
EP0P7SHM0U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZETELETINIB
INN   USAN  
Official Name English
zeteletinib [INN]
Common Name English
2-(6-(6,7-DIMETHOXYQUINOLIN-3-YL)PYRIDINE-3-YL))-N-(3-(1,1,1-TRIFLUORO-2-METHYLPROPAN-2-YL)-1,2-OXAZOL-5-YL)ACETAMIDE
Systematic Name English
CAXM-1190B
Code English
RET INHIBITOR DS-5010
Common Name English
DS-5010B
Code English
3-PYRIDINEACETAMIDE, 6-(6,7-DIMETHOXY-3-QUINOLINYL)-N-(3-(2,2,2-TRIFLUORO-1,1-DIMETHYLETHYL)-5-ISOXAZOLYL)-
Systematic Name English
ZETELETINIB [USAN]
Common Name English
Zeteletinib [WHO-DD]
Common Name English
BOS172738
Code English
BOS-172738
Code English
Code System Code Type Description
NCI_THESAURUS
C158093
Created by admin on Sat Dec 16 15:13:08 GMT 2023 , Edited by admin on Sat Dec 16 15:13:08 GMT 2023
PRIMARY
PUBCHEM
134391533
Created by admin on Sat Dec 16 15:13:08 GMT 2023 , Edited by admin on Sat Dec 16 15:13:08 GMT 2023
PRIMARY
CAS
2216753-97-6
Created by admin on Sat Dec 16 15:13:08 GMT 2023 , Edited by admin on Sat Dec 16 15:13:08 GMT 2023
PRIMARY
INN
11523
Created by admin on Sat Dec 16 15:13:08 GMT 2023 , Edited by admin on Sat Dec 16 15:13:08 GMT 2023
PRIMARY INN
SMS_ID
300000026761
Created by admin on Sat Dec 16 15:13:08 GMT 2023 , Edited by admin on Sat Dec 16 15:13:08 GMT 2023
PRIMARY
FDA UNII
EP0P7SHM0U
Created by admin on Sat Dec 16 15:13:08 GMT 2023 , Edited by admin on Sat Dec 16 15:13:08 GMT 2023
PRIMARY
USAN
KL-16
Created by admin on Sat Dec 16 15:13:08 GMT 2023 , Edited by admin on Sat Dec 16 15:13:08 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY