Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=C(Cl)C=C1)C(=O)NC1CCN(C1)C1=NNC(=C1)C1=CC=C(F)C=C1

InChIKey

InChIKey=FXSCNHAEHSQLSV-UHFFFAOYSA-N

Formula

C21H20ClFN4O2

Mass

414.87

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Pyrazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrazoles

Alternative Parents

3-halobenzoic acids and derivatives Benzamides Phenoxy compounds Anisoles Methoxybenzenes Dialkylarylamines Benzoyl derivatives Alkyl aryl ethers Fluorobenzenes Chlorobenzenes Imidolactams Aryl chlorides Aryl fluorides Pyrrolidines Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylpyrazole - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Dialkylarylamine - Phenol ether - Alkyl aryl ether - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrrolidine - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Ether - Azacycle - Carboxylic acid derivative - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Amine - 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

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