Structure Information
Structure

Compound Identification

SMILES

OC1=CC=CC=C1C1=CC(NC(=S)N1)C1=CC(O)=C(O)C=C1

InChIKey

InChIKey=KXMZAEDXSXNSQL-UHFFFAOYSA-N

Formula

C16H14N2O3S

Mass

314.36

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenols

Subclass

Benzenediols

Intermediate Tree Nodes

Not available

Direct Parent

Catechols

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Catechol - 2-thiopyrimidine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Thiopyrimidine - Pyrimidinethione - Monocyclic benzene moiety - Hydropyrimidine - Pyrimidine - 1,2,3,4-tetrahydropyrimidine - Thiourea - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as catechols. These are compounds containing a 1,2-benzenediol moiety.

External Descriptors

Not available

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