Structure Information
Structure

Compound Identification

SMILES

[O-][N+]1=C(C2=CC=CC=C2F)C2=C(C=CC(Cl)=C2)N2C=NC(N3CCOCC3)=C2C1

InChIKey

InChIKey=KTOKJJQOTQLLIW-UHFFFAOYSA-N

Formula

C21H18ClFN4O2

Mass

412.85

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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

Imidazo[1,5-a][1,4]benzodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Imidazo[1,5-a][1,4]benzodiazepine - Dialkylarylamine - Para-diazepine - Fluorobenzene - Halobenzene - Aminoimidazole - Monocyclic benzene moiety - Oxazinane - Benzenoid - Morpholine - Aryl fluoride - Imidolactam - Aryl halide - N-substituted imidazole - Aryl chloride - Heteroaromatic compound - Azole - Imidazole - Nitrone - Ether - Dialkyl ether - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Oxacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as imidazo[1,5-a][1,4]benzodiazepines. These are compounds containing an imidazole ring and a 1,4-benzodiazepine ring system, both sharing one nitrogen atom.

External Descriptors

Not available

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