Structure Information
Structure

Compound Identification

SMILES

CC1=CC(SC(=O)CC2=CC=C(C=C2)[N+]([O-])=O)=CC=C1

InChIKey

InChIKey=DVFINWBMKJKJLS-UHFFFAOYSA-N

Formula

C15H13NO3S

Mass

287.33

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrobenzenes

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Nitrobenzene - Thiophenol ester - Aryl thioether - Nitroaromatic compound - Toluene - C-nitro compound - Organic nitro compound - Carbothioic s-ester - Thiocarboxylic acid ester - Carboxylic acid derivative - Organic oxoazanium - Thiocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carbonyl group - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.

External Descriptors

Not available

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