Structure Information
Structure

Compound Identification

SMILES

CNC1=NC2=C(C=C(Cl)C=C2)C(=NC1)C1=CC=CC=C1F

InChIKey

InChIKey=HXBIKXSRZGPORM-UHFFFAOYSA-N

Formula

C16H13ClFN3

Mass

301.75

Export to:

JSON SDF CSV

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

Fluorobenzenes Imidolactams Aryl fluorides Aryl chlorides Ketimines Propargyl-type 1,3-dipolar organic compounds Carboxamidines Azacyclic compounds Organofluorides Organochlorides Hydrocarbon derivatives Amines

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1,4-benzodiazepine - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Imidolactam - Monocyclic benzene moiety - Benzenoid - Ketimine - Amidine - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid amidine - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organonitrogen compound - Imine - Organofluoride - Organohalogen compound - Organochloride - 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

Previous Back Next