Structure Information
Structure

Compound Identification

SMILES

CN1CCN(CC1)C(\N=O)=C1\CN=C(C2=CCC(=O)C=C2F)C2=C(N1)C=CC(Cl)=C2

InChIKey

InChIKey=NHUGHTPOTDYWKZ-VZCXRCSSSA-N

Formula

C21H21ClFN5O2

Mass

429.88

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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 - Secondary aliphatic/aromatic amine - N-methylpiperazine - N-alkylpiperazine - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Benzenoid - Vinylogous halide - Ketimine - Ketone - Tertiary amine - Tertiary aliphatic amine - Cyclic ketone - Azacycle - Vinyl halide - Vinyl fluoride - Organic 1,3-dipolar compound - Organic nitroso compound - Secondary amine - Propargyl-type 1,3-dipolar organic compound - Haloalkene - C-nitroso compound - Fluoroalkene - Enamine - Organic nitrogen compound - Organochloride - Organohalogen compound - Amine - Imine - Organofluoride - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - 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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