Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC=C1C1CC(C2=CC=CC=C2)C2=CC=CC=C2S1

InChIKey

InChIKey=PYVMVCNNGMCZIW-UHFFFAOYSA-N

Formula

C21H17ClS

Mass

336.88

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thiochromanes

Subclass

Thioflavans

Intermediate Tree Nodes

Not available

Direct Parent

Thioflavans

Alternative Parents

1-benzothiopyrans Chlorobenzenes Alkylarylthioethers Thiopyrans Aryl chlorides Organochlorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Thioflavan - 1-benzothiopyran - Benzothiopyran - Aryl thioether - Chlorobenzene - Halobenzene - Alkylarylthioether - Thiopyran - Aryl chloride - Monocyclic benzene moiety - Benzenoid - Aryl halide - Thioether - Organochloride - Organohalogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thioflavans. These are compounds containing a thiochromane skeleton substituted at the 2-position with a phenyl group.

External Descriptors

Not available

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