Structure Information
Structure

Compound Identification

SMILES

CN1CCN(CC1)C1=C2C=C(C)SC2=NC2=CC=CC=C2N1.CN1CCN(CC1)C1=C2C=CC=CC2=NC2=C(N1)C=C(Cl)C=C2.OCCOCCN1CCN(CC1)C1=NC2=CC=CC=C2SC2=CC=CC=C12

InChIKey

InChIKey=UJHXXIDMASCWKB-UHFFFAOYSA-N

Formula

C56H64ClN11O2S2

Mass

1022.77

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiazepines

Subclass

Dibenzothiazepines

Intermediate Tree Nodes

Not available

Direct Parent

Dibenzothiazepines

Alternative Parents

Dibenzodiazepines 1,4-benzodiazepines Diarylthioethers Thienodiazepines 1,4-diazepines N-methylpiperazines Aryl chlorides Benzenoids Imidolactams Thiophenes Heteroaromatic compounds Trialkylamines Dialkyl ethers Carboxamidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organochlorides Primary alcohols Hydrocarbon derivatives

Molecular Framework

Not available

Substituents

Dibenzodiazepine - Dibenzothiazepine - Benzodiazepine - 1,4-benzodiazepine - Diarylthioether - Thieno-para-diazepine - Aryl thioether - Para-diazepine - N-alkylpiperazine - N-methylpiperazine - Aryl chloride - Aryl halide - Piperazine - Imidolactam - 1,4-diazinane - Benzenoid - Heteroaromatic compound - Thiophene - Tertiary aliphatic amine - Tertiary amine - Amidine - Azacycle - Carboxylic acid amidine - Dialkyl ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Ether - Amine - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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