Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(C#N)C1=C(C(C)CC(C)(C)C1)C(SC)=C(C#N)C#N

InChIKey

InChIKey=SNAXQATUHXPAEC-UHFFFAOYSA-N

Formula

C18H21N3O2S

Mass

343.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Monoterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Monocyclic monoterpenoids

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

Monocyclic monoterpenoid - Methyl ester - Carboxylic acid ester - Thioenolether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Cyanide - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as monocyclic monoterpenoids. These are monoterpenoids containing 1 ring in the isoprene chain.

External Descriptors

Not available

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