Structure Information
Structure

Compound Identification

SMILES

CN1CC2=C(N=CN2C2=C(C=C(C=C2)C#C)C1=O)C(=O)OCCCOC(=O)C1=C2CN(C)C(=O)C3=C(C=CC(=C3)C#C)N2C=N1

InChIKey

InChIKey=JYRRJDFICVOODX-UHFFFAOYSA-N

Formula

C33H26N6O6

Mass

602.607

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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 - Para-diazepine - Imidazole-4-carbonyl group - Dicarboxylic acid or derivatives - N-substituted imidazole - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Tertiary carboxylic acid amide - Vinylogous amide - Carboxamide group - Carboxylic acid ester - Lactam - Acetylide - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - 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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