Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1CCN(CC1)C(=O)[C@@H](C)SC1=NN=C([C@@H]2COC3=CC=CC=C3O2)N1C

InChIKey

InChIKey=XMQVFFACHOOFHD-KDOFPFPSSA-N

Formula

C22H28N4O5S

Mass

460.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodioxanes

Subclass

Benzo-1,4-dioxanes

Intermediate Tree Nodes

Not available

Direct Parent

Benzo-1,4-dioxanes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzo-1,4-dioxane - N-acyl-piperidine - Piperidinecarboxylic acid - Aryl thioether - Alkyl aryl ether - Alkylarylthioether - Benzenoid - Piperidine - Para-dioxin - Heteroaromatic compound - Azole - 1,2,4-triazole - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Tertiary amine - Oxacycle - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Thioether - Ether - Monocarboxylic acid or derivatives - Amine - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzo-1,4-dioxanes. These are heterocyclic compounds containing a benzene ring fused to a 1,4-dioxane ring.

External Descriptors

Not available

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