Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(C)O\C(S1)=C1/C(=O)N(N=C1C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=GHZZKGOJVGLCCY-OQKWZONESA-N

Formula

C22H18N2O4S

Mass

406.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azolines

Subclass

Pyrazolines

Intermediate Tree Nodes

Not available

Direct Parent

Pyrazolones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Monocyclic benzene moiety - Pyrazolinone - Benzenoid - Vinylogous thioester - Monothioacetal - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous ester - Carboxylic acid ester - Ketene acetal or derivatives - Thioenolether - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Azacycle - Carbonyl group - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrazolones. These are compounds containing a pyrazole ring which bears a ketone.

External Descriptors

Not available

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