Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(CSC2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl)C=C1

InChIKey

InChIKey=ZECUQAHSCBNYKB-UHFFFAOYSA-N

Formula

C12H6Cl6N4O2S

Mass

482.97

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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 - Alkyl-2-thio-s-triazine - Aryl thioether - Nitroaromatic compound - Alkylarylthioether - Triazine - 1,3,5-triazine - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Organic oxoazanium - Thioether - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organonitrogen compound - Organochloride - Organopnictogen compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - 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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