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

Details

Stereochemistry ACHIRAL
Molecular Formula C16H11Cl2N5O4
Molecular Weight 408.196
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(2-(5-(4,5-DICHLORO-2-NITROPHENYL)-4-NITROIMIDAZOL-1-YL)ETHYL)PYRIDINE

SMILES

[O-][N+](=O)C1=C(N(CCC2=CC=CC=N2)C=N1)C3=C(C=C(Cl)C(Cl)=C3)[N+]([O-])=O

InChI

InChIKey=PGUCVSUTTATNFI-UHFFFAOYSA-N
InChI=1S/C16H11Cl2N5O4/c17-12-7-11(14(22(24)25)8-13(12)18)15-16(23(26)27)20-9-21(15)6-4-10-3-1-2-5-19-10/h1-3,5,7-9H,4,6H2

HIDE SMILES / InChI

Molecular Formula C16H11Cl2N5O4
Molecular Weight 408.196
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 23:08:10 GMT 2025
Edited
by admin
on Mon Mar 31 23:08:10 GMT 2025
Record UNII
8298GEX31M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(2-(5-(4,5-DICHLORO-2-NITROPHENYL)-4-NITROIMIDAZOL-1-YL)ETHYL)PYRIDINE
Systematic Name English
PYRIDINE, 2-(2-(5-(4,5-DICHLORO-2-NITROPHENYL)-4-NITRO-1H-IMIDAZOL-1-YL)ETHYL)-
Preferred Name English
Code System Code Type Description
CAS
14268-81-6
Created by admin on Mon Mar 31 23:08:10 GMT 2025 , Edited by admin on Mon Mar 31 23:08:10 GMT 2025
PRIMARY
FDA UNII
8298GEX31M
Created by admin on Mon Mar 31 23:08:10 GMT 2025 , Edited by admin on Mon Mar 31 23:08:10 GMT 2025
PRIMARY
PUBCHEM
121488132
Created by admin on Mon Mar 31 23:08:10 GMT 2025 , Edited by admin on Mon Mar 31 23:08:10 GMT 2025
PRIMARY