Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(C=C1)C1=C(NC2CCCCC2)N2C=CN=C(Cl)C2=N1

InChIKey

InChIKey=DTGJAFRBRXKGAY-UHFFFAOYSA-N

Formula

C18H18ClN5O2

Mass

371.83

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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

Imidazopyrazines Nitrobenzenes Nitroaromatic compounds Pyrazines Aminoimidazoles Aryl chlorides N-substituted imidazoles Heteroaromatic compounds Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Organic salts Organochlorides Hydrocarbon derivatives Amines Organopnictogen compounds Organic cations

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5-phenylimidazole - 4-phenylimidazole - Nitrobenzene - Imidazopyrazine - Nitroaromatic compound - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Pyrazine - Aminoimidazole - Benzenoid - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic oxoazanium - Organic salt - Organic oxide - Organochloride - Organonitrogen compound - Organohalogen compound - Amine - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic 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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