Compound Identification
SMILES
C1=CC=CC=C1.CC(C)(C)C1=NN2C=CC(=NC2=N1)C#C
InChIKey
InChIKey=BUTDYZNWJSHZGT-UHFFFAOYSA-N
Formula
C17H18N4
Mass
278.359
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
Pyrimidines and pyrimidine derivatives Benzene and substituted derivatives Triazoles Heteroaromatic compounds Aromatic hydrocarbons Azacyclic compounds Acetylides Unsaturated hydrocarbons Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Triazolopyrimidine - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Azole - Aromatic hydrocarbon - Heteroaromatic compound - 1,2,4-triazole - Triazole - Acetylide - Azacycle - Organic nitrogen compound - Unsaturated hydrocarbon - Hydrocarbon derivative - Organonitrogen compound - Hydrocarbon - 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