Structure Information
Structure

Compound Identification

SMILES

CNCCSC1CC2=C(SC3=CC=CC=C13)C=CC(Cl)=C2

InChIKey

InChIKey=QIXGKOOQAPYTEG-UHFFFAOYSA-N

Formula

C17H18ClNS2

Mass

335.91

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiepins

Subclass

Dibenzothiepins

Intermediate Tree Nodes

Not available

Direct Parent

Dibenzothiepins

Alternative Parents

Diarylthioethers Benzenoids Aryl chlorides Sulfenyl compounds Dialkylthioethers Dialkylamines Organochlorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzothiepin - Diarylthioether - Aryl thioether - Aryl chloride - Aryl halide - Benzenoid - Secondary aliphatic amine - Dialkylthioether - Secondary amine - Thioether - Sulfenyl compound - Organochloride - Organohalogen compound - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dibenzothiepins. These are compounds containing a dibenzothiepin moiety, which consists of two benzene connected by a thiepine ring.

External Descriptors

Not available

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