Structure Information
Structure

Compound Identification

SMILES

COC1=C(C2=CN3C(C)=CSC3=N2)C(=C(OC)C=C1)[N+]([O-])=O

InChIKey

InChIKey=ISPWDXROVFEHRX-UHFFFAOYSA-N

Formula

C14H13N3O4S

Mass

319.34

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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

Nitrophenyl ethers Dimethoxybenzenes Methoxyanilines Anisoles Phenoxy compounds Imidazothiazoles Nitroaromatic compounds Alkyl aryl ethers N-substituted imidazoles Thiazoles Heteroaromatic compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic salts Hydrocarbon derivatives Organonitrogen compounds Organic oxides Organic cations

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-phenylimidazole - 5-phenylimidazole - Nitrophenyl ether - Dimethoxybenzene - P-dimethoxybenzene - Nitrobenzene - Methoxyaniline - Phenoxy compound - Phenol ether - Nitroaromatic compound - Anisole - Imidazothiazole - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Thiazole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Ether - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen 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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