Structure Information
Structure

Compound Identification

SMILES

Cc1ccc(cc1)-[n+]1noc([O-])c1C(=O)CSC1=NN=C(Cc2ccc(Br)cc2)C(=O)N1N

InChIKey

InChIKey=QHHSTUWORVNIKT-UHFFFAOYSA-N

Formula

C21H17BrN6O4S

Mass

529.37

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organosulfur compounds

Class

Thioethers

Subclass

Aryl thioethers

Intermediate Tree Nodes

Not available

Direct Parent

Aryl thioethers

Alternative Parents

Aryl alkyl ketones Toluenes Alkylarylthioethers Bromobenzenes 1,2,4-triazines Aryl bromides Vinylogous acids 1,2,3-oxadiazoles Heteroaromatic compounds Lactams Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organobromides Organonitrogen compounds

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl ketone - Aryl thioether - Aryl alkyl ketone - Alkylarylthioether - Toluene - Halobenzene - Bromobenzene - Triazine - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - 1,2,4-triazine - 1,2,3-oxadiazole - Vinylogous acid - Oxadiazole - Azole - Heteroaromatic compound - Ketone - Lactam - Organoheterocyclic compound - Azacycle - Oxacycle - Sulfenyl compound - Organic salt - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic zwitterion - Aromatic heteromonocyclic compound

Description

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

External Descriptors

Not available

Previous Back Next