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Details

Stereochemistry ACHIRAL
Molecular Formula C22H25ClFN7OS
Molecular Weight 489.001
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FLUORO-DASATINIB F-18

SMILES

Cc1cccc(c1N=C(c2cnc(Nc3cc(nc(C)n3)N4CCN(CCF)CC4)s2)O)Cl

InChI

InChIKey=PLZOWXHKTJJSQR-MIGPCILRSA-N
InChI=1S/C22H25ClFN7OS/c1-14-4-3-5-16(23)20(14)29-21(32)17-13-25-22(33-17)28-18-12-19(27-15(2)26-18)31-10-8-30(7-6-24)9-11-31/h3-5,12-13H,6-11H2,1-2H3,(H,29,32)(H,25,26,27,28)/i24-1

HIDE SMILES / InChI

Molecular Formula C22H25ClFN7OS
Molecular Weight 489.001
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 Fri Jun 25 21:28:43 UTC 2021
Edited
by admin
on Fri Jun 25 21:28:43 UTC 2021
Record UNII
KD0C0X4Y6E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FLUORO-DASATINIB F-18
Common Name English
SKI-249380 F-18
Common Name English
FLUORO(F18)-DASATINIB
Common Name English
FLUORINE F 18 SKI-249380
Common Name English
18F-DASATINIB
Common Name English
5-THIAZOLECARBOXAMIDE, N-(2-CHLORO-6-METHYLPHENYL)-2-((6-(4-(2-(FLUORO-18F)ETHYL)-1-PIPERAZINYL)-2-METHYL-4-PYRIMIDINYL)AMINO)-
Systematic Name English
(18F) SKI-249380
Code English
18F-SKI-249380
Common Name English
(18F)-N-(2-CHLORO-6-METHYLPHENYL)-2-(6-(4-(2-FLUOROETHYL)PIPERAZIN-1-YL)-2-METHYLPYRIMIDIN-4-YLAMINO)THIAZOLE-5-CARBOXAMIDE
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C2124
Created by admin on Fri Jun 25 21:28:43 UTC 2021 , Edited by admin on Fri Jun 25 21:28:43 UTC 2021
Code System Code Type Description
CAS
957218-03-0
Created by admin on Fri Jun 25 21:28:43 UTC 2021 , Edited by admin on Fri Jun 25 21:28:43 UTC 2021
PRIMARY
FDA UNII
KD0C0X4Y6E
Created by admin on Fri Jun 25 21:28:43 UTC 2021 , Edited by admin on Fri Jun 25 21:28:43 UTC 2021
PRIMARY
PUBCHEM
23657440
Created by admin on Fri Jun 25 21:28:43 UTC 2021 , Edited by admin on Fri Jun 25 21:28:43 UTC 2021
PRIMARY
NCI_THESAURUS
C111576
Created by admin on Fri Jun 25 21:28:43 UTC 2021 , Edited by admin on Fri Jun 25 21:28:43 UTC 2021
PRIMARY
Related Record Type Details
TARGET->RADIOLIGAND
NON-LABELED -> LABELED
TARGET->RADIOLIGAND