Compound Identification
SMILES
CC1=C(C=CC(NC2=C3C(=CC=NC3=O)N(N2)C(CC#N)C2CC2)=C1)C(N)C(F)(F)F
InChIKey
InChIKey=FSEOZJLACZHXLN-UHFFFAOYSA-N
Formula
C21H21F3N6O
Mass
430.435
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Aniline and substituted anilines
Intermediate Tree Nodes
Not available
Direct Parent
Aniline and substituted anilines
Alternative Parents
Toluenes Pyridinones Aralkylamines Vinylogous amides Pyrazoles Heteroaromatic compounds Nitriles Azacyclic compounds Organooxygen compounds Organofluorides Organic oxides Monoalkylamines Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aniline or substituted anilines - Pyridinone - Toluene - Aralkylamine - Pyridine - Azole - Pyrazole - Heteroaromatic compound - Vinylogous amide - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Cyanide - Organic oxygen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Primary aliphatic amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
External Descriptors
Not available