Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(SC2=NC=NC(NNC(=O)C3=CC=C(Cl)C=C3)=C2[N+]([O-])=O)C=C1

InChIKey

InChIKey=FSFUSVUSLOWILL-UHFFFAOYSA-N

Formula

C18H14ClN5O3S

Mass

415.85

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organosulfur compounds

Class

Thioethers

Subclass

Aryl thioethers

Intermediate Tree Nodes

Not available

Direct Parent

Diarylthioethers

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Diarylthioether - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Nitroaromatic compound - Benzoyl - Thiophenol ether - Chlorobenzene - Halobenzene - Toluene - Imidolactam - Monocyclic benzene moiety - Aryl chloride - Benzenoid - Pyrimidine - Aryl halide - Heteroaromatic compound - Organic nitro compound - Carboxylic acid hydrazide - C-nitro compound - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Sulfenyl compound - Organic zwitterion - Organic oxygen compound - Organohalogen compound - Organic salt - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as diarylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two aryl groups.

External Descriptors

Not available

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