Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C1=NC(=CS1)C1=CC(C(O)=O)=C(C)N1CCCCC1=CC=CC=C1

InChIKey

InChIKey=IGVIYDBPDGFJLU-UHFFFAOYSA-N

Formula

C26H26N2O3S

Mass

446.57

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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 heteromonocyclic compounds

Substituents

Phenylbutylamine - Anisole - Phenol ether - Pyrrole-3-carboxylic acid - Pyrrole-3-carboxylic acid or derivatives - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - 2,4-disubstituted 1,3-thiazole - Substituted pyrrole - Thiazole - Vinylogous amide - Pyrrole - Heteroaromatic compound - Azole - Carboxylic acid derivative - Azacycle - Carboxylic acid - Ether - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - 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

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