Compound Identification
SMILES
CCC(C)OC(=O)N1CC(CC1CC)N(CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C1=NC=C(C=N1)C1=CN(C)N=C1
InChIKey
InChIKey=SMKZRYUCORUOAE-UHFFFAOYSA-N
Formula
C28H32F6N6O2
Mass
598.594
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
Pyrrolidine carboxylic acids Dialkylarylamines Benzylamines Aminopyrimidines and derivatives Pyrazoles Heteroaromatic compounds Carbamate esters Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Benzylamine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Dialkylarylamine - Aminopyrimidine - Pyrimidine - Azole - Pyrazole - Heteroaromatic compound - Pyrrolidine - Carbamic acid ester - Organoheterocyclic compound - Azacycle - Alkyl halide - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl fluoride - Organic oxygen compound - Amine - Hydrocarbon derivative - Aromatic heteromonocyclic 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