Compound Identification
SMILES
CC1=CC=C(C=C1)C1=CC(N2NC=NC2=N1)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=HWBMEYNDMZMDHQ-UHFFFAOYSA-N
Formula
C18H15N5O2
Mass
333.351
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
Nitrobenzenes Nitroaromatic compounds Toluenes Hydropyrimidines Triazolines Amidrazones Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Formamidines Azacyclic compounds Organic zwitterions Organic salts Organic oxides Imines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrobenzene - Triazolopyrimidine - Nitroaromatic compound - Toluene - Monocyclic benzene moiety - Hydropyrimidine - 1,6-dihydropyrimidine - Benzenoid - Triazoline - Carboxylic acid amidrazone - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic oxoazanium - Amidine - Formamidine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic zwitterion - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Imine - Organic oxygen compound - Organic nitrogen compound - Organic salt - 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