Structure Information
Structure

Compound Identification

SMILES

COCCN1CCC(CC1)NC1=CC2=C(C(=C3NC4=CC=CC=C4N3)C3=CC(OC)=CC=C3)C(=O)N=C2C=C1

InChIKey

InChIKey=COEMUQCMFDXCHN-UHFFFAOYSA-N

Formula

C31H33N5O3

Mass

523.637

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzimidazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzimidazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzimidazole - Indole or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - 4-aminopiperidine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Piperidine - Amino acid or derivatives - N-acylimine - Ketene acetal or derivatives - Tertiary aliphatic amine - Tertiary amine - Ether - Dialkyl ether - Carboxylic acid derivative - Azacycle - Secondary amine - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).

External Descriptors

Not available

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