Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C2CN3C(CC4=CC=C(C=C4)[N+]([O-])=O)=NN=C3C3=C(C=CC(Cl)=C3)N2C=N1

InChIKey

InChIKey=KRYSXAZZLYDGSG-UHFFFAOYSA-N

Formula

C22H17ClN6O4

Mass

464.87

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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 - Triazolo-para-diazepine - Nitrobenzene - Nitroaromatic compound - Para-diazepine - Imidazole-4-carbonyl group - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Azole - Heteroaromatic compound - Imidazole - 1,2,4-triazole - Vinylogous amide - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Azacycle - Organic nitrogen compound - Organohalogen compound - Organic oxygen compound - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organic zwitterion - Organic salt - Organooxygen compound - Organic oxide - 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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