Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(NC(=O)C2=CC=C(C=C2)C(C)C)SC2=C1CCCCC2

InChIKey

InChIKey=PERWQADYWAYXME-UHFFFAOYSA-N

Formula

C21H25NO3S

Mass

371.5

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Cycloheptathiophenes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Cycloheptathiophenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

P-cymene - Aromatic monoterpenoid - Bicyclic monoterpenoid - Cycloheptathiophene - Monoterpenoid - Benzamide - Benzoic acid or derivatives - Cumene - Phenylpropane - Benzoyl - Thiophene carboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Thiophene - Methyl ester - Vinylogous amide - Heteroaromatic compound - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cycloheptathiophenes. These are polycyclic compounds containing a thiophene ring fused to a 7 member carbocyclic moiety. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom.

External Descriptors

Not available

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