Compound Identification
SMILES
FC(F)(F)C1=CC=CC(CS(=O)(=O)N2CCC(CC2)C2=NC(=C(N2)C2=CC=CC=N2)C2=CC3=C(OCO3)C=C2)=C1
InChIKey
InChIKey=PCCZEQHMOCIYSN-UHFFFAOYSA-N
Formula
C28H25F3N4O4S
Mass
570.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
Benzodioxoles 2,4,5-trisubstituted imidazoles Pyridines and derivatives Organic sulfonamides Organosulfonamides Piperidines Heteroaromatic compounds Sulfonyls Acetals Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Organopnictogen compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Benzodioxole - 2,4,5-trisubstituted-imidazole - Trisubstituted imidazole - Piperidine - Pyridine - Organic sulfonic acid amide - Organosulfonic acid amide - Azole - Imidazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Azacycle - Organoheterocyclic compound - Oxacycle - Acetal - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Alkyl halide - Organic nitrogen compound - Organic oxide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available