Compound Identification
SMILES
NC1=NC(SCC2=CC=C(OC(F)(F)F)C=C2)=NC=C1C#N
InChIKey
InChIKey=MSSHZDHYXBCRQI-UHFFFAOYSA-N
Formula
C13H9F3N4OS
Mass
326.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol ethers
Alternative Parents
Phenoxy compounds Aminopyrimidines and derivatives Alkylarylthioethers Imidolactams Heteroaromatic compounds Trihalomethanes Sulfenyl compounds Nitriles Azacyclic compounds Primary amines Organooxygen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Aryl thioether - Phenol ether - Aminopyrimidine - Alkylarylthioether - Monocyclic benzene moiety - Pyrimidine - Imidolactam - Heteroaromatic compound - Trihalomethane - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Sulfenyl compound - Thioether - Alkyl fluoride - Primary amine - Cyanide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Halomethane - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
External Descriptors
Not available