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Details

Stereochemistry ACHIRAL
Molecular Formula C17H10BrCl2N5O
Molecular Weight 451.104
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(1H)-QUINAZOLINONE, 2-(3-BROMO-1-(3-CHLORO-2-PYRIDINYL)-1H-PYRAZOL-5-YL)-6-CHLORO-8-METHYL-

SMILES

CC1=CC(Cl)=CC2=C1NC(=NC2=O)C3=CC(Br)=NN3C4=NC=CC=C4Cl

InChI

InChIKey=SKGIOUHBCKFJRT-UHFFFAOYSA-N
InChI=1S/C17H10BrCl2N5O/c1-8-5-9(19)6-10-14(8)22-15(23-17(10)26)12-7-13(18)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,22,23,26)

HIDE SMILES / InChI

Molecular Formula C17H10BrCl2N5O
Molecular Weight 451.104
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 Mon Mar 31 22:01:10 GMT 2025
Edited
by admin
on Mon Mar 31 22:01:10 GMT 2025
Record UNII
QFK6AN3PUE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4(3H)-QUINAZOLINONE, 2-(3-BROMO-1-(3-CHLORO-2-PYRIDINYL)-1H-PYRAZOL-5-YL)-6-CHLORO-8-METHYL-
Preferred Name English
4-(1H)-QUINAZOLINONE, 2-(3-BROMO-1-(3-CHLORO-2-PYRIDINYL)-1H-PYRAZOL-5-YL)-6-CHLORO-8-METHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
QFK6AN3PUE
Created by admin on Mon Mar 31 22:01:11 GMT 2025 , Edited by admin on Mon Mar 31 22:01:11 GMT 2025
PRIMARY
EPA CompTox
DTXSID40904891
Created by admin on Mon Mar 31 22:01:11 GMT 2025 , Edited by admin on Mon Mar 31 22:01:11 GMT 2025
PRIMARY
CAS
1264747-05-8
Created by admin on Mon Mar 31 22:01:11 GMT 2025 , Edited by admin on Mon Mar 31 22:01:11 GMT 2025
PRIMARY
PUBCHEM
135564546
Created by admin on Mon Mar 31 22:01:11 GMT 2025 , Edited by admin on Mon Mar 31 22:01:11 GMT 2025
PRIMARY