Compound Identification
SMILES
NC(=O)C1=CC=C(C=C1)N1N=C(C=C1C1=CC=C(CCCCN=[N+]=[N-])C=C1)C(F)(F)F
InChIKey
InChIKey=HDLRWDKKOYFPKK-UHFFFAOYSA-N
Formula
C21H19F3N6O
Mass
428.419
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
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Subclass
Pyrazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
Phenylbutylamines Benzamides Benzoyl derivatives Heteroaromatic compounds Primary carboxylic acid amides Azo imides Azo compounds Azacyclic compounds Organooxygen compounds Organofluorides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbutylamine - Phenylpyrazole - Benzamide - Benzoic acid or derivatives - Benzoyl - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azo compound - Primary carboxylic acid amide - Azo imide - Carboxamide group - Azacycle - Carboxylic acid derivative - Alkyl halide - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - Organic salt - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors
Not available