Structure Information
Structure

Compound Identification

SMILES

CC1(C)CCC2=C(C(C3=CC=C(S3)C#N)C3=C(CCS3)N2)C1=O

InChIKey

InChIKey=PAQBJNDKMBNTPZ-UHFFFAOYSA-N

Formula

C18H18N2OS2

Mass

342.48

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones

Direct Parent

Cyclohexenones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dihydropyridine - 2,5-disubstituted thiophene - Cyclohexenone - 2,3-dihydrothiophene - Thiophene - Vinylogous amide - Heteroaromatic compound - Thioenolether - Organoheterocyclic compound - Secondary aliphatic amine - Nitrile - Carbonitrile - Enamine - Azacycle - Cyanide - Organonitrogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.

External Descriptors

Not available

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