Structure Information
Structure

Compound Identification

SMILES

CCC1CCC(CC1)C(=O)N[C@@H](CC1=CC=C(OCC2=CC=C(C=C2)C(O)=O)C=C1)C1=NC(=CN1CC#CC)C1=C(Cl)C=C(Cl)C=C1

InChIKey

InChIKey=XFUDKWTTYYMXJP-CHAGMNPESA-N

Formula

C38H39Cl2N3O4

Mass

672.65

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles

Direct Parent

Phenylimidazoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

5-phenylimidazole - 4-phenylimidazole - Amphetamine or derivatives - Benzoic acid or derivatives - Benzoic acid - 1,2,4-trisubstituted-imidazole - Phenoxy compound - Benzoyl - 1,3-dichlorobenzene - Imidazolyl carboxylic acid derivative - Phenol ether - Trisubstituted imidazole - Halobenzene - Alkyl aryl ether - Chlorobenzene - Aryl halide - Benzenoid - Monocyclic benzene moiety - N-substituted imidazole - Aryl chloride - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Ether - Carboxylic acid derivative - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organonitrogen compound - Organochloride - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.

External Descriptors

Not available

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