Structure Information
Structure

Compound Identification

SMILES

OCCN1CCN(CC1)C1CC2=C(SC3=C1C=C(Cl)C=C3)C=CC(Cl)=C2

InChIKey

InChIKey=RITAQUDKGCYTMA-UHFFFAOYSA-N

Formula

C20H22Cl2N2OS

Mass

409.37

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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 N-alkylpiperazines Aralkylamines Benzenoids Aryl chlorides Trialkylamines 1,2-aminoalcohols Azacyclic compounds Primary alcohols Organochlorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzothiepin - Diarylthioether - Aryl thioether - N-alkylpiperazine - Aralkylamine - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Benzenoid - Tertiary amine - Tertiary aliphatic amine - 1,2-aminoalcohol - Thioether - Azacycle - Alkanolamine - Primary alcohol - Organochloride - Organohalogen compound - Organic nitrogen compound - Organonitrogen compound - Alcohol - Organooxygen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - 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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