Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=CC(F)=C1)C1=CN=C(SCC2=NC=CN2)N1C1=CC=C(Cl)C=C1

InChIKey

InChIKey=UHJHJHKZMKIBQT-UHFFFAOYSA-N

Formula

C20H16ClFN4OS

Mass

414.88

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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

1,2,5-trisubstituted imidazoles Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Alkylarylthioethers Fluorobenzenes Chlorobenzenes N-substituted imidazoles Aryl chlorides Aryl fluorides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organochlorides Organofluorides Organonitrogen compounds

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

5-phenylimidazole - 4-phenylimidazole - 1-phenylimidazole - 1,2,5-trisubstituted-imidazole - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Phenol ether - Trisubstituted imidazole - Alkyl aryl ether - Halobenzene - Fluorobenzene - Alkylarylthioether - Chlorobenzene - N-substituted imidazole - Aryl halide - Aryl fluoride - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Heteroaromatic compound - Azacycle - Sulfenyl compound - Thioether - Ether - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - 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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