Compound Identification
SMILES
FC1=CC=CC=C1N1C=CC(NCC2CCC3(CN(C(=O)O3)C3=CC=C(C=C3)C#N)CC2)=N1
InChIKey
InChIKey=WKTHIOUWYRKEBZ-UHFFFAOYSA-N
Formula
C25H24FN5O2
Mass
445.498
Taxonomic Classification
Taxonomy Tree
-
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
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
Azaspirodecane derivatives Benzonitriles Fluorobenzenes Oxazolidinones Aryl fluorides Imidolactams Carbamate esters Heteroaromatic compounds Nitriles Azacyclic compounds Oxacyclic compounds Carbonyl compounds Amines Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Azaspirodecane - Benzonitrile - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Oxazolidinone - Monocyclic benzene moiety - Benzenoid - Imidolactam - Carbamic acid ester - Oxazolidine - Heteroaromatic compound - Carbonitrile - Nitrile - Azacycle - Oxacycle - Amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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