Compound Identification
SMILES
CC[C@H](SC1=NC=NC2=C1N=NN2CC1=CC=CC=C1F)C(O)=O
InChIKey
InChIKey=PINOOACXWPZMAG-NSHDSACASA-N
Formula
C15H14FN5O2S
Mass
347.37
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
Thia fatty acids Alkylarylthioethers Fluorobenzenes Pyrimidines and pyrimidine derivatives Aryl fluorides Triazoles Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triazolopyrimidine - Aryl thioether - Fluorobenzene - Halobenzene - Thia fatty acid - Alkylarylthioether - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Aryl fluoride - Pyrimidine - Aryl halide - Heteroaromatic compound - Azole - 1,2,3-triazole - Triazole - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Thioether - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - 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