Structure Information
Structure

Compound Identification

SMILES

NC1=C(C#N)C2=C(CSC3=CC=CC=C23)C(C2=CC=CC=C2)=C1C#N

InChIKey

InChIKey=BYKQOOKSPPJYPJ-UHFFFAOYSA-N

Formula

C21H13N3S

Mass

339.42

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiopyrans

Subclass

2-benzothiopyrans

Intermediate Tree Nodes

Not available

Direct Parent

2-benzothiopyrans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzothiopyran - 2-benzothiopyran - Aryl thioether - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Thioether - Nitrile - Carbonitrile - Organic nitrogen compound - Primary amine - Organonitrogen compound - Amine - Hydrocarbon derivative - Cyanide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-benzothiopyrans. These are organic aromatic compounds that 1-benzothiopyran, a bicyclic compound made up of a benzene ring fused to a thiopyran, so that the sulfur atom is at the 2-position.

External Descriptors

Not available

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