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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H11F6N5O2
Molecular Weight 467.3241
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SAFIMALTIB

SMILES

FC(F)(F)C1=C(C=NN1C2=CC=CC3=C2C=CNC3=O)C(=O)NC4=CC(=NC=C4)C(F)(F)F

InChI

InChIKey=APWRZPQBPCAXFP-UHFFFAOYSA-N
InChI=1S/C20H11F6N5O2/c21-19(22,23)15-8-10(4-6-27-15)30-18(33)13-9-29-31(16(13)20(24,25)26)14-3-1-2-12-11(14)5-7-28-17(12)32/h1-9H,(H,28,32)(H,27,30,33)

HIDE SMILES / InChI

Approval Year

Name Type Language
SAFIMALTIB
INN  
Official Name English
JNJ-67856633
Code English
1-(1-OXO-1,2-DIHYDROISOQUINOLIN-5-YL)-5-(TRIFLUOROMETHYL)-N-(2-(TRIFLUOROMETHYL)PYRIDIN-4-YL)-1H-PYRAZOLE-4-CARBOXAMIDE
Systematic Name English
Safimaltib [WHO-DD]
Common Name English
JNJ67856633
Code English
safimaltib [INN]
Common Name English
1H-PYRAZOLE-4-CARBOXAMIDE, 1-(1,2-DIHYDRO-1-OXO-5-ISOQUINOLINYL)-5-(TRIFLUOROMETHYL)-N-(2-(TRIFLUOROMETHYL)-4-PYRIDINYL)-
Systematic Name English
Code System Code Type Description
SMS_ID
300000042078
Created by admin on Sat Dec 16 14:18:08 GMT 2023 , Edited by admin on Sat Dec 16 14:18:08 GMT 2023
PRIMARY
FDA UNII
L9790S42AI
Created by admin on Sat Dec 16 14:18:08 GMT 2023 , Edited by admin on Sat Dec 16 14:18:08 GMT 2023
PRIMARY
CAS
2230273-76-2
Created by admin on Sat Dec 16 14:18:08 GMT 2023 , Edited by admin on Sat Dec 16 14:18:08 GMT 2023
PRIMARY
PUBCHEM
134609793
Created by admin on Sat Dec 16 14:18:08 GMT 2023 , Edited by admin on Sat Dec 16 14:18:08 GMT 2023
PRIMARY
NCI_THESAURUS
C160147
Created by admin on Sat Dec 16 14:18:08 GMT 2023 , Edited by admin on Sat Dec 16 14:18:08 GMT 2023
PRIMARY
INN
12060
Created by admin on Sat Dec 16 14:18:08 GMT 2023 , Edited by admin on Sat Dec 16 14:18:08 GMT 2023
PRIMARY