Structure Information
Structure

Compound Identification

SMILES

FC1=CC=C(OCCN2CCN(CC2)C2CC3=C(SC4=C2C=C(Cl)C=C4)C=C(F)C=C3)C=C1

InChIKey

InChIKey=SQUUAADSFLDLHF-UHFFFAOYSA-N

Formula

C26H25ClF2N2OS

Mass

487.01

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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 Phenoxy compounds Phenol ethers N-alkylpiperazines Fluorobenzenes Aralkylamines Alkyl aryl ethers Aryl fluorides Aryl chlorides Trialkylamines Azacyclic compounds Organofluorides Organochlorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzothiepin - Diarylthioether - Aryl thioether - Phenoxy compound - Phenol ether - Fluorobenzene - Halobenzene - Aralkylamine - Alkyl aryl ether - N-alkylpiperazine - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Piperazine - Tertiary amine - Tertiary aliphatic amine - Azacycle - Ether - Thioether - Organofluoride - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - 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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