Structure Information
Structure

Compound Identification

SMILES

NC1=CC=CC=C1SC[C@H]1CO[C@](CCC2=CC=C(Cl)C=C2)(CN2C=CN=C2)O1

InChIKey

InChIKey=WOBSVVYLPWQEIY-KNQAVFIVSA-N

Formula

C22H24ClN3O2S

Mass

429.96

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 heteromonocyclic compounds

Substituents

Phenylbutylamine - Aryl thioether - Aniline or substituted anilines - Thiophenol ether - Ketal - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - N-substituted imidazole - Primary aromatic amine - Meta-dioxolane - Azole - Heteroaromatic compound - Imidazole - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organohalogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Primary amine - Aromatic heteromonocyclic 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