Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(COC2=C(Cl)C=C(C=C2)C(=S)N2CCN(CC3=CC=CC=C3)CC2)C=C1

InChIKey

InChIKey=NVAKCSKQJFUGRT-UHFFFAOYSA-N

Formula

C25H24ClN3O3S

Mass

482.0

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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 - Phenoxy compound - Nitroaromatic compound - Benzylamine - Phenol ether - Phenylmethylamine - Alkyl aryl ether - Chlorobenzene - Aralkylamine - Halobenzene - N-alkylpiperazine - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Thioamide - Organic nitro compound - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Thiocarboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Ether - Organoheterocyclic compound - Organic oxoazanium - Organic oxygen compound - Thiocarbonyl group - Organochloride - Organohalogen compound - Organic salt - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - 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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