Structure Information
Structure

Compound Identification

SMILES

CCCCC1=NN2C(S1)=NC(=O)C(=CC1=C(C)N(C(C)=C1)C1=CC(Cl)=C(Cl)C=C1)C2=N

InChIKey

InChIKey=CXEMQVYDISCBQM-UHFFFAOYSA-N

Formula

C22H21Cl2N5OS

Mass

474.4

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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

Dichlorobenzenes Pyrimidones Aryl chlorides Imidolactams Hydropyrimidines Thiadiazolines Heteroaromatic compounds N-acylimines Amidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids and derivatives Carbonyl compounds Organochlorides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenylpyrrole - 1,2-dichlorobenzene - Chlorobenzene - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Hydropyrimidine - Benzenoid - Pyrimidine - 1,4,5,6-tetrahydropyrimidine - Heteroaromatic compound - Thiadiazoline - N-acylimine - Amidine - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - 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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