Structure Information
Structure

Compound Identification

SMILES

COC1=CC(C[NH+]2CCN3C(CC2)=NN=C3[C@@H](CC(C)C)NC(=O)C2=CN=CC=C2)=C(O)C=C1

InChIKey

InChIKey=VXLWCSBGZLYENO-OAQYLSRUSA-O

Formula

C25H33N6O3

Mass

465.577

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Triazolodiazepines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Triazolodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Methoxyphenol - Triazolo-para-diazepine - 4-alkoxyphenol - Nicotinamide - Pyridine carboxylic acid or derivatives - Phenoxy compound - Anisole - Benzylamine - Methoxybenzene - Phenol ether - Phenylmethylamine - Para-diazepine - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Aralkylamine - Phenol - Monocyclic benzene moiety - Benzenoid - Pyridine - 1,2,4-triazole - Quaternary ammonium salt - Azole - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Ether - Carboxylic acid derivative - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as triazolodiazepines. These are heterocyclic aromatic compounds containing a triazole ring fused to a diazepine ring. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. Diazepine is a 7-membered ring consisting of five carbon and two nitrogen atoms.

External Descriptors

Not available

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