Structure Information
Structure

Compound Identification

SMILES

CCSC1=C(C#N)C(CC(=O)N1)C1=CC(=CC=C1)[N+]([O-])=O

InChIKey

InChIKey=LSTOEXRFQJJFRK-UHFFFAOYSA-N

Formula

C14H13N3O3S

Mass

303.34

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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 heteromonocyclic compounds

Substituents

Nitrobenzene - Nitroaromatic compound - Tetrahydropyridine - Hydropyridine - Carboxamide group - Ketene acetal or derivatives - Lactam - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Sulfenyl compound - Organoheterocyclic compound - Carbonitrile - Nitrile - Carboxylic acid derivative - Organic oxoazanium - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic salt - Cyanide - Carbonyl group - Organic cation - Aromatic heteromonocyclic 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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