Structure Information
Structure

Compound Identification

SMILES

CCN(CC)C1=CC(=O)\C(=C\NNC2=NC(=O)CS2)C=C1

InChIKey

InChIKey=PGJPATZCIYJVOK-CSKARUKUSA-N

Formula

C14H18N4O2S

Mass

306.38

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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

Aliphatic heteromonocyclic compounds

Substituents

O-quinomethane - Meta-thiazoline - Vinylogous amide - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - N-acylimine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Enamine - Organoheterocyclic compound - Azacycle - Organopnictogen compound - Amine - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aliphatic 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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