Compound Identification
SMILES
C[C@@H](O)CNC1=NC2=NNN=C2C(NC2=CC=C(F)C=C2)=N1
InChIKey
InChIKey=WVRSUYBBNWZNGN-SSDOTTSWSA-N
Formula
C13H14FN7O
Mass
303.301
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
Aniline and substituted anilines Fluorobenzenes Aminopyrimidines and derivatives Imidolactams Aryl fluorides Triazoles Heteroaromatic compounds Secondary alcohols Azacyclic compounds Organofluorides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triazolopyrimidine - Aniline or substituted anilines - Aminopyrimidine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrimidine - Azole - Heteroaromatic compound - 1,2,3-triazole - Triazole - Secondary alcohol - Azacycle - Organofluoride - Organohalogen compound - Organic nitrogen compound - Amine - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen 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