Structure Information
Structure

Compound Identification

SMILES

Cl.Cl.CN1CCN=C(\C=C\C2=CC=CC=C2SCC2=CC=C(Cl)C=C2)C2=CC=CC=C12

InChIKey

InChIKey=XPLXKVQPAOBPCC-BXHFOUFMSA-N

Formula

C25H25Cl3N2S

Mass

491.9

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodiazepines

Subclass

1,4-benzodiazepines

Intermediate Tree Nodes

Not available

Direct Parent

1,4-benzodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1,4-benzodiazepine - Aryl thioether - Dialkylarylamine - Styrene - Tertiary aliphatic/aromatic amine - Thiophenol ether - Chlorobenzene - Alkylarylthioether - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Ketimine - Tertiary amine - Sulfenyl compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Thioether - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Imine - Hydrochloride - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.

External Descriptors

Not available

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