Structure Information
Structure

Compound Identification

SMILES

COC(=O)CC[C@@H]1N=C(C2=CC=CC=C2F)C2=C(C=CC(Cl)=C2)N2C(C)=CN=C12

InChIKey

InChIKey=GCVWKECVGWHUEU-SFHVURJKSA-N

Formula

C22H19ClFN3O2

Mass

411.86

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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 - Halobenzene - Fluorobenzene - Fatty acid ester - Aryl chloride - Aryl fluoride - Aryl halide - N-substituted imidazole - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Azole - Imidazole - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Ketimine - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organofluoride - Imine - Organochloride - Hydrocarbon derivative - Organohalogen 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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