Structure Information
Structure

Compound Identification

SMILES

CC1=C(SC=C1)C1C(C#N)=C(N)SC2=C1C(=O)CC(C)(C)C2

InChIKey

InChIKey=QPQOQJCHCVXYET-UHFFFAOYSA-N

Formula

C17H18N2OS2

Mass

330.46

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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

Cyclohexenone - Thiopyran - Vinylogous thioester - Thiophene - Heteroaromatic compound - Ketene acetal or derivatives - Thioenolether - Carbonitrile - Nitrile - Organoheterocyclic compound - Cyanide - Organonitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - 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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