Compound Identification
SMILES
FC(F)(F)C1=CC(NC2=NN=C(CC3=CC=NC=C3)C3=CC=CC=C23)=CC(Cl)=C1
InChIKey
InChIKey=WNZGYQPKBYGLJT-UHFFFAOYSA-N
Formula
C21H14ClF3N4
Mass
414.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazanaphthalenes
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Subclass
Benzodiazines
- Level 5 Phthalazines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Not available
Direct Parent
Phthalazines
Alternative Parents
Trifluoromethylbenzenes Aniline and substituted anilines Chlorobenzenes Aminopyridazines Pyridines and derivatives Imidolactams Aryl chlorides Heteroaromatic compounds Secondary amines Azacyclic compounds Organofluorides Organochlorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Phthalazine - Aniline or substituted anilines - Aminopyridazine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridazine - Pyridine - Benzenoid - Imidolactam - Heteroaromatic compound - Azacycle - Secondary amine - Organofluoride - Organochloride - Organohalogen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Organic nitrogen compound - Alkyl fluoride - Alkyl halide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phthalazines. These are compounds containing a phthalazine moiety, which consists of a benzene ring fused to a pyridazine, forming a 2,3-benzodiazine skeleton.
External Descriptors
Not available