Structure Information
Structure

Compound Identification

SMILES

CCN(CC)CC[N+]1([O-])N=C2C3=C1C=CC(C)=C3SC1=C2C=CC(OC)=C1

InChIKey

InChIKey=YRIIVPBWTCPQIT-UHFFFAOYSA-N

Formula

C21H25N3O2S

Mass

383.51

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiopyrans

Subclass

1-benzothiopyrans

Intermediate Tree Nodes

Not available

Direct Parent

Thioxanthenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Thioxanthene - Diarylthioether - Benzopyrazole - Aryl thioether - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Tertiary amine - Tertiary aliphatic amine - Ether - Azacycle - Thioether - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organic salt - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thioxanthenes. These are organic polycyclic compounds containing a thioxanthene moiety, which is an aromatic tricycle derived from xanthene by replacing the oxygen atom with a sulfur atom.

External Descriptors

Not available

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