Structure Information
Structure

Compound Identification

SMILES

NC(=O)C1=C(N=C2SCCN12)C1=CC=CC=C1

InChIKey

InChIKey=KSTMFLBVEIZUFR-UHFFFAOYSA-N

Formula

C12H11N3OS

Mass

245.3

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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

Imidazothiazoles 2-heteroaryl carboxamides Carbonylimidazoles Alkylarylthioethers N-substituted imidazoles Benzene and substituted derivatives Heteroaromatic compounds Primary carboxylic acid amides Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5-phenylimidazole - 4-phenylimidazole - 2-heteroaryl carboxamide - Aryl thioether - Imidazothiazole - Imidazole-4-carbonyl group - Alkylarylthioether - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Primary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Thioether - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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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