Structure Information
Structure

Compound Identification

SMILES

CC1=CN2C(S1)=NC(=C2\C=C\C(=O)C1=CC=CO1)C1=CC(=C(Cl)C=C1)[N+]([O-])=O

InChIKey

InChIKey=MTIVKBYUUZIKOM-VOTSOKGWSA-N

Formula

C19H12ClN3O4S

Mass

413.83

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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

Nitrobenzenes Aryl ketones Nitroaromatic compounds Chlorobenzenes Aryl chlorides N-substituted imidazoles Acryloyl compounds Thiazoles Enones Furans Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organonitrogen compounds Hydrocarbon derivatives Organochlorides Organic zwitterions Organic oxides Organic salts

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-phenylimidazole - 5-phenylimidazole - Nitrobenzene - Nitroaromatic compound - Aryl ketone - Halobenzene - Chlorobenzene - Benzenoid - Aryl chloride - Aryl halide - N-substituted imidazole - Monocyclic benzene moiety - Acryloyl-group - Thiazole - Alpha,beta-unsaturated ketone - Heteroaromatic compound - Furan - Enone - Organic nitro compound - Ketone - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Oxacycle - Organic oxoazanium - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic zwitterion - Organic oxygen compound - Organic salt - Organic nitrogen compound - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen 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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