Structure Information
Structure

Compound Identification

SMILES

OC(CNC1=CC(=CC=C1)[N+]([O-])=O)CSC1=NC(C2=CC=CC=C2)=C(N=N1)C1=CC=CC=C1

InChIKey

InChIKey=ICBHZJDZBMNUFL-UHFFFAOYSA-N

Formula

C24H21N5O3S

Mass

459.52

Export to:

JSON SDF CSV

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 - Aryl thioether - Nitroaromatic compound - Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Alkylarylthioether - 1,2,4-triazine - Triazine - Heteroaromatic compound - 1,2-aminoalcohol - C-nitro compound - Secondary alcohol - Organic nitro compound - Organic oxoazanium - Azacycle - Secondary amine - Thioether - Organoheterocyclic compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Alcohol - Hydrocarbon derivative - Organosulfur compound - Amine - Organic oxygen compound - Organic oxide - Organic zwitterion - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic salt - 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

Previous Back Next