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Details

Stereochemistry ACHIRAL
Molecular Formula C13H8N6
Molecular Weight 248.2428
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TOPIROXOSTAT

SMILES

N#CC1=NC=CC(=C1)C2=NNC(=N2)C3=CC=NC=C3

InChI

InChIKey=UBVZQGOVTLIHLH-UHFFFAOYSA-N
InChI=1S/C13H8N6/c14-8-11-7-10(3-6-16-11)13-17-12(18-19-13)9-1-4-15-5-2-9/h1-7H,(H,17,18,19)

HIDE SMILES / InChI

Molecular Formula C13H8N6
Molecular Weight 248.2428
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 Dec 15 16:42:18 UTC 2023
Edited
by admin
on Fri Dec 15 16:42:18 UTC 2023
Record UNII
0J877412JV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TOPIROXOSTAT
INN   WHO-DD  
INN  
Official Name English
FYX-051
Code English
TOPIROXOSTAT [MI]
Common Name English
Topiroxostat [WHO-DD]
Common Name English
topiroxostat [INN]
Common Name English
4-(5-(PYRIDIN-4-YL)-1H-1,2,4-TRIAZOL-3-YL)PYRIDINE-2-CARBONITRILE
Systematic Name English
TOPIROXOSTAT [JAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C1637
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
Code System Code Type Description
EVMPD
SUB177917
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
FDA UNII
0J877412JV
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
DRUG BANK
DB01685
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
MERCK INDEX
m11864
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
INN
9220
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
PUBCHEM
5288320
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
WIKIPEDIA
Topiroxostat
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
EPA CompTox
DTXSID80206462
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
NCI_THESAURUS
C96311
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
DRUG CENTRAL
4888
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
SMS_ID
100000163592
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
CAS
577778-58-6
Created by admin on Fri Dec 15 16:42:18 UTC 2023 , Edited by admin on Fri Dec 15 16:42:18 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY