Compound Identification
SMILES
CC1=CC(CNC2=CC(C)=NC3=NC(NC4=C(C)C=CC(C)=C4)=NN23)=NC=C1
InChIKey
InChIKey=KTNQPEZURZONEO-UHFFFAOYSA-N
Formula
C21H23N7
Mass
373.464
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
p-Xylenes Aniline and substituted anilines 2-pyridylmethylamines Methylpyridines Aminopyrimidines and derivatives Triazoles Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triazolopyrimidine - 2-pyridylmethylamine - P-xylene - Xylene - Aniline or substituted anilines - Aminopyrimidine - Methylpyridine - Benzenoid - Pyrimidine - Pyridine - Monocyclic benzene moiety - Azole - Heteroaromatic compound - 1,2,4-triazole - Triazole - Azacycle - Amine - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen 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