Structure Information
Structure

Compound Identification

SMILES

COCC1=CC(C)=NC(NN=CC2=C(C)N(C(C)=C2)C2=CC=C(Br)C=C2)=C1C#N

InChIKey

InChIKey=FCQODGKKNSTNAM-UHFFFAOYSA-N

Formula

C22H22BrN5O

Mass

452.356

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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-pyridinecarbonitriles Methylpyridines Bromobenzenes Imidolactams Aryl bromides Heteroaromatic compounds Nitriles Hydrazones Dialkyl ethers Azacyclic compounds Organobromides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1-phenylpyrrole - 3-pyridinecarbonitrile - Methylpyridine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyridine - Heteroaromatic compound - Dialkyl ether - Ether - Azacycle - Hydrazone - Carbonitrile - Nitrile - Cyanide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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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