Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C=C2C(=N)N3N=C(CCC4CCCCC4)SC3=NC2=O)=C(C)N1C1=CC=C(Cl)C=C1

InChIKey

InChIKey=NECSTWIMKPYFTO-UHFFFAOYSA-N

Formula

C26H28ClN5OS

Mass

494.05

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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

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