Structure Information
Structure

Compound Identification

SMILES

CCN1N=NC(=N1)C1=CC2=C(C=C1)N(C=C2C1CCN(CCN2CCNC2=O)CC1)C1=CC=C(F)C=C1

InChIKey

InChIKey=CFKLWZPURWBZAA-UHFFFAOYSA-N

Formula

C27H31FN8O

Mass

502.598

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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

3-alkylindoles Fluorobenzenes Aralkylamines Piperidines Imidazolidinones Aryl fluorides Tetrazoles Heteroaromatic compounds Ureas Trialkylamines Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenylpyrrole - 3-alkylindole - Indole - Indole or derivatives - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Imidazolidinone - Piperidine - Benzenoid - Tetrazole - Imidazolidine - Heteroaromatic compound - Azole - Tertiary amine - Urea - Tertiary aliphatic amine - Azacycle - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - 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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