Structure Information
Structure

Compound Identification

SMILES

CC1=C(C)C=C(C=C1)N1C(N)=C(C(=O)NCC2=CC=C(Cl)C=C2)C2=NC3=CC=CC=C3N=C12

InChIKey

InChIKey=ZINGIENKOMQCTH-UHFFFAOYSA-N

Formula

C26H22ClN5O

Mass

455.95

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrroles

Subclass

Substituted pyrroles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrroles

Alternative Parents

Quinoxalines Pyrrolopyrazines o-Xylenes Pyrrole carboxamides Chlorobenzenes Aryl chlorides Pyrazines Vinylogous amides Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Organooxygen compounds Primary amines

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenylpyrrole - Quinoxaline - Pyrrolopyrazine - O-xylene - Xylene - Pyrrole-3-carboxamide - Pyrrole-3-carboxylic acid or derivatives - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrazine - Benzenoid - Vinylogous amide - Heteroaromatic compound - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - Primary amine - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.

External Descriptors

Not available

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