Structure Information
Structure

Compound Identification

SMILES

CN(C[C@@H]1COC2=CC=CC=C2O1)C(=O)C1=CC=CC=C1CSC1=NN2C(=N1)N=C(C)C=C2C

InChIKey

InChIKey=PCTFDOGXHTVMKN-LJQANCHMSA-N

Formula

C25H25N5O3S

Mass

475.57

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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 - Benzamide - Benzoic acid or derivatives - Triazolopyrimidine - Aryl thioether - Benzoyl - Alkyl aryl ether - Alkylarylthioether - Monocyclic benzene moiety - Para-dioxin - Pyrimidine - Benzenoid - 1,2,4-triazole - Triazole - Tertiary carboxylic acid amide - Azole - Heteroaromatic compound - Tertiary amine - Amino acid or derivatives - Carboxamide group - Thioether - Azacycle - Sulfenyl compound - Oxacycle - Ether - Carboxylic acid derivative - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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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