Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(CNCC(O)C(CC2=CC=CC=C2)NC(=O)C(O)CCSC2=CC=CC=C2)=C1

InChIKey

InChIKey=QTSSCYBBAUYOSN-UHFFFAOYSA-N

Formula

C28H34N2O4S

Mass

494.65

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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 - Amphetamine or derivatives - Benzylamine - Anisole - Phenol ether - Phenylmethylamine - Thiophenol ether - Methoxybenzene - Phenoxy compound - Aryl thioether - Alkyl aryl ether - Alkylarylthioether - Aralkylamine - Monosaccharide - Fatty amide - N-acyl-amine - Fatty acyl - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Secondary alcohol - 1,2-aminoalcohol - Secondary aliphatic amine - Ether - Secondary amine - Thioether - Sulfenyl compound - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Alcohol - 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

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