You are using an unsupported browser. Please upgrade your browser to a newer version to get the best experience on ClassyFire.
Structure Information
Structure

Compound Identification

SMILES

CC1=CC(Br)=CC(Cl)=C1CCCCNCCSS(O)(=O)=O

InChIKey

InChIKey=QYYNAXXWKWESCM-UHFFFAOYSA-N

Formula

C13H19BrClNO3S2

Mass

416.77

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylbutylamines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylbutylamines

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Phenylbutylamine - Bromobenzene - Chlorobenzene - Halobenzene - Aralkylamine - Toluene - Aryl bromide - Aryl chloride - Aryl halide - S-alkyl thiosulfate - Secondary aliphatic amine - Secondary amine - Sulfenyl compound - Organosulfur compound - Organonitrogen compound - Organochloride - Organobromide - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.

External Descriptors

Not available

Previous Back Next