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

Details

Stereochemistry ACHIRAL
Molecular Formula C19H24ClN3O4
Molecular Weight 393.865
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(3-((5-CHLORO-1-ETHYL-1,6-DIHYDRO-6-OXO-4-PYRIDAZINYL)AMINO)PROPOXY)-3-PROPYLBENZOIC ACID

SMILES

CCCC1=CC(=CC=C1OCCCNC2=C(Cl)C(=O)N(CC)N=C2)C(O)=O

InChI

InChIKey=ZGRLHYNHBATWKF-UHFFFAOYSA-N
InChI=1S/C19H24ClN3O4/c1-3-6-13-11-14(19(25)26)7-8-16(13)27-10-5-9-21-15-12-22-23(4-2)18(24)17(15)20/h7-8,11-12,21H,3-6,9-10H2,1-2H3,(H,25,26)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
4-(3-((5-CHLORO-1-ETHYL-1,6-DIHYDRO-6-OXO-4-PYRIDAZINYL)AMINO)PROPOXY)-3-PROPYLBENZOIC ACID
Systematic Name English
4-(3-((5-CHLORO-1-ETHYL-6-OXO-1,6-DIHYDRO-4-PYRIDAZINYL)AMINO)PROPOXY)-3-PROPYLBENZOIC ACID
Preferred Name English
4-(3-((5-CHLORO-1-ETHYL-6-OXOPYRIDAZIN-4-YL)AMINO)PROPOXY)-3-PROPYLBENZOIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
13987675
Created by admin on Wed Apr 02 12:02:03 GMT 2025 , Edited by admin on Wed Apr 02 12:02:03 GMT 2025
PRIMARY
FDA UNII
1BE39O6905
Created by admin on Wed Apr 02 12:02:03 GMT 2025 , Edited by admin on Wed Apr 02 12:02:03 GMT 2025
PRIMARY
CAS
105170-63-6
Created by admin on Wed Apr 02 12:02:03 GMT 2025 , Edited by admin on Wed Apr 02 12:02:03 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966