Structure Information
Structure

Compound Identification

SMILES

O=C(OCCSSCC1=CC2=C(OCO2)C=C1)C1=CN=CC=C1

InChIKey

InChIKey=ZVDLXUAWAKLCNE-UHFFFAOYSA-N

Formula

C16H15NO4S2

Mass

349.42

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodioxoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzodioxoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzodioxole - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Pyridine - Benzenoid - Heteroaromatic compound - Carboxylic acid ester - Organic disulfide - Dialkyldisulfide - Acetal - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.

External Descriptors

Not available

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