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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H20F3N5O2S2
Molecular Weight 518.565
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DABRAFENIB F-18

SMILES

CC(C)(C)C1=NC(=C(S1)C2=NC(N)=NC=C2)C3=CC=CC(NS(=O)(=O)C4=C([18F])C=CC=C4F)=C3F

InChI

InChIKey=BFSMGDJOXZAERB-MIGPCILRSA-N
InChI=1S/C23H20F3N5O2S2/c1-23(2,3)21-30-18(19(34-21)16-10-11-28-22(27)29-16)12-6-4-9-15(17(12)26)31-35(32,33)20-13(24)7-5-8-14(20)25/h4-11,31H,1-3H3,(H2,27,28,29)/i24-1

HIDE SMILES / InChI

Approval Year

Name Type Language
DABRAFENIB F-18
Common Name English
FLUORINE F 18 DABRAFENIB
Common Name English
18F DABRAFENIB
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C2124
Created by admin on Sat Dec 16 11:54:08 GMT 2023 , Edited by admin on Sat Dec 16 11:54:08 GMT 2023
Code System Code Type Description
NCI_THESAURUS
C126653
Created by admin on Sat Dec 16 11:54:08 GMT 2023 , Edited by admin on Sat Dec 16 11:54:08 GMT 2023
PRIMARY NCIT
FDA UNII
M9WIX3U8T4
Created by admin on Sat Dec 16 11:54:08 GMT 2023 , Edited by admin on Sat Dec 16 11:54:08 GMT 2023
PRIMARY
PUBCHEM
135390918
Created by admin on Sat Dec 16 11:54:08 GMT 2023 , Edited by admin on Sat Dec 16 11:54:08 GMT 2023
PRIMARY