Structure Information
Structure

Compound Identification

SMILES

CC1(C)CC2=C(SC3C=CC=CC3N2)C(=O)C1C(=O)C(N)=O

InChIKey

InChIKey=KHDAVCNMONWVAD-UHFFFAOYSA-N

Formula

C16H18N2O3S

Mass

318.39

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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

Aliphatic heteropolycyclic compounds

Substituents

Cyclohexenone - 1,3-diketone - Para-thiazine - 1,3-dicarbonyl compound - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Primary carboxylic acid amide - Thioenolether - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Secondary amine - Azacycle - Organoheterocyclic compound - Amine - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Organic nitrogen compound - Aliphatic 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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