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Details

Stereochemistry ACHIRAL
Molecular Formula C25H23FN8O2S2
Molecular Weight 550.631
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SAR-125844

SMILES

FC1=CC=C(C=C1)C2=NN3C(SC4=CC=C5N=C(NC(=O)NCCN6CCOCC6)SC5=C4)=NN=C3C=C2

InChI

InChIKey=ODIUNTQOXRXOIV-UHFFFAOYSA-N
InChI=1S/C25H23FN8O2S2/c26-17-3-1-16(2-4-17)19-7-8-22-30-31-25(34(22)32-19)37-18-5-6-20-21(15-18)38-24(28-20)29-23(35)27-9-10-33-11-13-36-14-12-33/h1-8,15H,9-14H2,(H2,27,28,29,35)

HIDE SMILES / InChI

Molecular Formula C25H23FN8O2S2
Molecular Weight 550.631
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 09:09:22 GMT 2023
Edited
by admin
on Sat Dec 16 09:09:22 GMT 2023
Record UNII
XH93U6NIJE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SAR-125844
Code English
UREA, N-(6-((6-(4-FLUOROPHENYL)-1,2,4-TRIAZOLO(4,3-B)PYRIDAZIN-3-YL)THIO)-2-BENZOTHIAZOLYL)-N'-(2-(4-MORPHOLINYL)ETHYL)-
Systematic Name English
SAR125844
Code English
SAR 125844
Code English
1-(6-((6-(4-FLUOROPHENYL)(1,2,4)TRIAZOLO(4,3-B)PYRIDAZIN-3-YL)SULFANYL)-1,3-BENZOTHIAZOL-2-YL)-3-(2-(MORPHOLIN-4-YL)ETHYL)UREA
Systematic Name English
Code System Code Type Description
ChEMBL
CHEMBL3545325
Created by admin on Sat Dec 16 09:09:22 GMT 2023 , Edited by admin on Sat Dec 16 09:09:22 GMT 2023
PRIMARY
CAS
1116743-46-4
Created by admin on Sat Dec 16 09:09:22 GMT 2023 , Edited by admin on Sat Dec 16 09:09:22 GMT 2023
PRIMARY
NCI_THESAURUS
C97511
Created by admin on Sat Dec 16 09:09:22 GMT 2023 , Edited by admin on Sat Dec 16 09:09:22 GMT 2023
PRIMARY
DRUG BANK
DB15382
Created by admin on Sat Dec 16 09:09:22 GMT 2023 , Edited by admin on Sat Dec 16 09:09:22 GMT 2023
PRIMARY
PUBCHEM
25182860
Created by admin on Sat Dec 16 09:09:22 GMT 2023 , Edited by admin on Sat Dec 16 09:09:22 GMT 2023
PRIMARY
SMS_ID
300000041397
Created by admin on Sat Dec 16 09:09:22 GMT 2023 , Edited by admin on Sat Dec 16 09:09:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID901031348
Created by admin on Sat Dec 16 09:09:22 GMT 2023 , Edited by admin on Sat Dec 16 09:09:22 GMT 2023
PRIMARY
FDA UNII
XH93U6NIJE
Created by admin on Sat Dec 16 09:09:22 GMT 2023 , Edited by admin on Sat Dec 16 09:09:22 GMT 2023
PRIMARY
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