Structure Information
Structure

Compound Identification

SMILES

ClC1=C(C=CC(=C1)C1=NC=NN1)C(=O)N1CC2=CC=CN2CC2=CC=CC=C12

InChIKey

InChIKey=XEMZNTKLIKDCEY-UHFFFAOYSA-N

Formula

C21H16ClN5O

Mass

389.84

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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 - Phenyl-1,2,4-triazole - Phenyltriazole - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Vinylogous halide - 1,2,4-triazole - Pyrrole - Tertiary carboxylic acid amide - Triazole - Carboxamide group - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - 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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