Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C=C2C(=N)N3C(SCC4=CC=CC=C4)=NSC3=NC2=O)=C(C)N1C1=C(C)C=CC=C1C

InChIKey

InChIKey=LKAABCFUZVDLQU-UHFFFAOYSA-N

Formula

C27H25N5OS2

Mass

499.65

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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

m-Xylenes Pyrimidones Hydropyrimidines Imidolactams Heteroaromatic compounds Thiadiazolines N-acylimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids and derivatives Carboximidamides Carboxamidines Sulfenyl compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenylpyrrole - M-xylene - Xylene - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyrimidine - Imidolactam - Benzenoid - Heteroaromatic compound - Thiadiazoline - N-acylimine - Sulfenyl compound - Carboxylic acid amidine - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amidine - Carboximidamide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic oxide - 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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