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Structure Information
Structure

Compound Identification

SMILES

COC1=C(CSC2=CC=CC=C2N)C=C2C(=O)C3=CC=CC=C3OC2=C1

InChIKey

InChIKey=VMGAYMORJUGJIC-UHFFFAOYSA-N

Formula

C21H17NO3S

Mass

363.43

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

Dibenzopyrans - Xanthenes

Direct Parent

Xanthones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Xanthone - Chromone - Aryl thioether - Anisole - Phenol ether - Aniline or substituted anilines - Thiophenol ether - Alkyl aryl ether - Alkylarylthioether - Pyranone - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Ether - Oxacycle - Sulfenyl compound - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Primary amine - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as xanthones. These are polycyclic aromatic compounds containing a xanthene moiety conjugated to a ketone group at carbon 9. Xanthene is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring.

External Descriptors

Not available

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