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

Details

Stereochemistry ACHIRAL
Molecular Formula C15H18N2O
Molecular Weight 242.3162
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(3,4-Dimethylphenyl)-2,4-dihydro-5-methyl-4-(1-methylethylidene)-3H-pyrazol-3-one

SMILES

CC(C)=C1C(=O)N(N=C1C)C2=CC(C)=C(C)C=C2

InChI

InChIKey=BGQJRYWSFRJDIY-UHFFFAOYSA-N
InChI=1S/C15H18N2O/c1-9(2)14-12(5)16-17(15(14)18)13-7-6-10(3)11(4)8-13/h6-8H,1-5H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
3H-Pyrazol-3-one, 2-(3,4-dimethylphenyl)-2,4-dihydro-5-methyl-4-(1-methylethylidene)-
Preferred Name English
2-(3,4-Dimethylphenyl)-2,4-dihydro-5-methyl-4-(1-methylethylidene)-3H-pyrazol-3-one
Systematic Name English
Code System Code Type Description
CAS
2715162-45-9
Created by admin on Wed Apr 02 20:33:30 GMT 2025 , Edited by admin on Wed Apr 02 20:33:30 GMT 2025
PRIMARY
FDA UNII
RJS6T2FY4K
Created by admin on Wed Apr 02 20:33:30 GMT 2025 , Edited by admin on Wed Apr 02 20:33:30 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