Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(CN=C(NC(=S)N2CCOCC2)C2=CC=C(Cl)C=C2)C=C1

InChIKey

InChIKey=OXGIFSKFLFKMGS-UHFFFAOYSA-N

Formula

C19H19ClN4O3S

Mass

418.9

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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 - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Morpholine - Oxazinane - C-nitro compound - Organic nitro compound - Thiourea - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Dialkyl ether - Carboximidamide - Organic 1,3-dipolar compound - Organoheterocyclic compound - Ether - Azacycle - Oxacycle - Carboxylic acid amidine - Organic oxoazanium - Amidine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - 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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