Compound Identification
SMILES
OC(=O)NCC[C@H](CCN1N=NC2=CC=CC=C12)NC1=CC=C(C=C1)C(F)(F)F
InChIKey
InChIKey=PUUAIEWGRAFLLZ-OAHLLOKOSA-N
Formula
C19H20F3N5O2
Mass
407.397
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
Benzotriazoles Phenylalkylamines Aniline and substituted anilines Secondary alkylarylamines Triazoles Heteroaromatic compounds Carbamic acids Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Benzotriazole - Aniline or substituted anilines - Phenylalkylamine - Secondary aliphatic/aromatic amine - Heteroaromatic compound - Azole - 1,2,3-triazole - Triazole - Carbamic acid - Carbamic acid derivative - Azacycle - Organoheterocyclic compound - Secondary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Amine - Alkyl halide - 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