Structure Information
Structure

Compound Identification

SMILES

CCC1=NN=C(N\C=C2\C=CC=C(OC)C2=O)S1

InChIKey

InChIKey=UILPMHLUTHUPOV-FPLPWBNLSA-N

Formula

C12H13N3O2S

Mass

263.32

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinomethanes

Direct Parent

O-quinomethanes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

O-quinomethane - 2-amino-5-substituted-1,3,4-thiadiazole - 2-amino-1,3,4-thiadiazole - Azole - Thiadiazole - Vinylogous amide - Heteroaromatic compound - Enamine - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.

External Descriptors

Not available

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