Structure Information
Structure

Compound Identification

SMILES

NC1=C(C=C2CCOC2=O)C=CS1

InChIKey

InChIKey=KNXOVXNFNWAJFL-UHFFFAOYSA-N

Formula

C9H9NO2S

Mass

195.24

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactones

Subclass

Gamma butyrolactones

Intermediate Tree Nodes

Not available

Direct Parent

Gamma butyrolactones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Gamma butyrolactone - 2-aminothiophene - Oxolane - Heteroaromatic compound - Thiophene - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Amine - Carbonyl group - Hydrocarbon derivative - Primary amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as gamma butyrolactones. These are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom.

External Descriptors

Not available

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