Structure Information
Structure

Compound Identification

SMILES

OCC1(OC(=O)C(O)=C1SC1=NC2=CC=CC=C2O1)C(S)C1=NC2=CC=CC=C2O1

InChIKey

InChIKey=TUPMQTYDNKBEDY-UHFFFAOYSA-N

Formula

C20H14N2O6S2

Mass

442.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzoxazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoxazole - Aryl thioether - 2-furanone - Benzenoid - Vinylogous thioester - Azole - Dihydrofuran - Oxazole - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Thioenolether - Carboxylic acid ester - Lactone - Oxacycle - Sulfenyl compound - Azacycle - Carboxylic acid derivative - Alkylthiol - Monocarboxylic acid or derivatives - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoxazoles. These are organic compounds containing a benzene fused to an oxazole ring Oxazole is five-membered aromatic ring with a nitrogen and an oxygen atoms at the 1- and 3-position, respectively.

External Descriptors

Not available

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