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Details

Stereochemistry ACHIRAL
Molecular Formula C24H25FN4O3
Molecular Weight 436.4787
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DHODH-IN-16

SMILES

CCN1C(=O)N(N=C1CO)C2=CC3=C(C=C2F)C(=O)N(C=C3C(C)C)C4=C(C)C=CC=C4

InChI

InChIKey=BZKHQYHQHLKJNX-UHFFFAOYSA-N
InChI=1S/C24H25FN4O3/c1-5-27-22(13-30)26-29(24(27)32)21-11-16-17(10-19(21)25)23(31)28(12-18(16)14(2)3)20-9-7-6-8-15(20)4/h6-12,14,30H,5,13H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C24H25FN4O3
Molecular Weight 436.4787
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 Wed Apr 02 09:53:07 GMT 2025
Edited
by admin
on Wed Apr 02 09:53:07 GMT 2025
Record UNII
DP88ZN62GS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DHODH-IN16
Preferred Name English
DHODH-IN-16
Common Name English
1(2H)-ISOQUINOLINONE, 6-(4-ETHYL-4,5-DIHYDRO-3-(HYDROXYMETHYL)-5-OXO-1H-1,2,4-TRIAZOL-1-YL)-7-FLUORO-4-(1-METHYLETHYL)-2-(2-METHYLPHENYL)-
Systematic Name English
6-[4-Ethyl-4,5-dihydro-3-(hydroxymethyl)-5-oxo-1H-1,2,4-triazol-1-yl]-7-fluoro-4-(1-methylethyl)-2-(2-methylphenyl)-1(2H)-isoquinolinone
Systematic Name English
Code System Code Type Description
PUBCHEM
155209570
Created by admin on Wed Apr 02 09:53:07 GMT 2025 , Edited by admin on Wed Apr 02 09:53:07 GMT 2025
PRIMARY
CAS
2511248-11-4
Created by admin on Wed Apr 02 09:53:07 GMT 2025 , Edited by admin on Wed Apr 02 09:53:07 GMT 2025
PRIMARY
FDA UNII
DP88ZN62GS
Created by admin on Wed Apr 02 09:53:07 GMT 2025 , Edited by admin on Wed Apr 02 09:53:07 GMT 2025
PRIMARY
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