Structure Information
Structure

Compound Identification

SMILES

CC1=C(C)C=C(C=C1)C1=NN(C(=C1)C(=O)N(CCC#N)CC1=CN=CC=C1)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=JGWBBCHNOHRJQT-UHFFFAOYSA-N

Formula

C27H24ClN5O

Mass

469.97

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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

o-Xylenes Pyrazole-5-carboxamides 2-heteroaryl carboxamides Chlorobenzenes Pyridines and derivatives Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Nitriles Azacyclic compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylpyrazole - 2-heteroaryl carboxamide - Pyrazole-5-carboxamide - Xylene - O-xylene - Chlorobenzene - Halobenzene - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Pyridine - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Azacycle - Carbonitrile - Nitrile - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - 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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