Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(O1)C1C(C#N)=C(NC2=C1C(=O)CC(C)(C)C2)SCC(=O)NC1=CC2=C(OCO2)C=C1

InChIKey

InChIKey=WHGOHAQMJUGFCO-UHFFFAOYSA-N

Formula

C26H25N3O5S

Mass

491.56

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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 - N-arylamide - Dihydropyridine - Cyclohexenone - Benzenoid - Furan - Heteroaromatic compound - Vinylogous amide - Carboxamide group - Ketene acetal or derivatives - Ketone - Secondary carboxylic acid amide - Acetal - Carboxylic acid derivative - Carbonitrile - Nitrile - Oxacycle - Sulfenyl compound - Azacycle - Hydrocarbon derivative - Organic oxide - Cyanide - Organopnictogen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxygen compound - Aldehyde - 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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