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Structure Information
Structure

Compound Identification

SMILES

CN(SCNC(=O)OC1=CC=CC2=C1OC(C)(C)C2)C=NC1=C(C)C=C(Cl)C=C1

InChIKey

InChIKey=OIMJYRCMMNLSSG-UHFFFAOYSA-N

Formula

C21H24ClN3O3S

Mass

433.95

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Coumarans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Coumarans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Coumaran - Alkyl aryl ether - Chlorobenzene - Halobenzene - Toluene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Carbamic acid ester - Amidine - Formamidine - Ether - Oxacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as coumarans. These are compounds containing the coumaran skeleton, which consists of a benzene ring fused to a 2,3-dihydrofuran ring.

External Descriptors

Not available

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