Compound Identification
SMILES
C[N+]1=CC=C(CC2N3N=CN=C3N=CC2=[N+]([O-])[O-])C=C1
InChIKey
InChIKey=GFQLJVVMFYGTJZ-UHFFFAOYSA-N
Formula
C12H12N6O2
Mass
272.268
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Triazolopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Triazolopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Triazolopyrimidines
Alternative Parents
N-methylpyridinium compounds Pyrimidines and pyrimidine derivatives Pyridinium derivatives Triazoles Heteroaromatic compounds Nitronic acids Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Allyl-type 1,3-dipolar organic compounds Organic zwitterions Organic salts Organic oxides Imines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triazolopyrimidine - N-methylpyridinium - Pyridine - Pyridinium - Pyrimidine - Azole - Heteroaromatic compound - Triazole - 1,2,4-triazole - Nitronic acid - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Imine - Organic zwitterion - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as triazolopyrimidines. These are polycyclic aromatic compounds containing triazole ring fused to a pyrimidine ring. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available