Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=C(CN2C=NC3=C2NC=NCC3O)C=C1

InChIKey

InChIKey=QAQIOWWCOTYXJM-UHFFFAOYSA-N

Formula

C15H16N4O3

Mass

300.318

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Imidazodiazepines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Imidazodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoate ester - Imidazo-meta-diazepine - Imidazodiazepine - Benzoic acid or derivatives - Benzoyl - Meta-diazepine - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Methyl ester - Secondary alcohol - Carboxylic acid ester - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Amidine - Azacycle - Carboxylic acid derivative - Carboxylic acid amidine - Formamidine - Organonitrogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Alcohol - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as imidazodiazepines. These are organic compounds containing an imidazole ring fused to a diazepine ring. Imidazole is 5-membered ring consisting of three carbon atoms, and two nitrogen centers at the 1- and 3-positions. Diazepine is a 7-membered ring consisting of five carbon and two nitrogen atoms.

External Descriptors

Not available

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