Structure Information
Structure

Compound Identification

SMILES

O=C1CSC(=O)C1=CNNC1=NC2=CC=CC=C2O1

InChIKey

InChIKey=ZCKATBJOCOEHRV-UHFFFAOYSA-N

Formula

C12H9N3O3S

Mass

275.28

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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 - Benzenoid - Azole - Oxazole - Thiolane - Heteroaromatic compound - Carbothioic s-lactone - Vinylogous amide - Ketone - Thiocarboxylic acid ester - Thiolactone - Cyclic ketone - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrazine derivative - Hydrocarbon derivative - Carbonyl group - 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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