Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1CCCCC(=O)[C@@H]1C1=CC=C(C)S1

InChIKey

InChIKey=KNXJDBJDOVQWRR-NOZJJQNGSA-N

Formula

C13H18OS

Mass

222.35

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thiophenes

Subclass

2,5-disubstituted thiophenes

Intermediate Tree Nodes

Not available

Direct Parent

2,5-disubstituted thiophenes

Alternative Parents

Heteroaromatic compounds Cyclic ketones Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2,5-disubstituted thiophene - Heteroaromatic compound - Cyclic ketone - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 2,5-disubstituted thiophenes. These are organic compounds containing a thiophene that is disubstituted at the C-2, and C5-positions.

External Descriptors

Not available

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