Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1CC2=C(O1)C=CC(NC1=NC=C(F)C(NC3=CC=C(Cl)C=C3)=N1)=C2

InChIKey

InChIKey=RUHDDEVVVZTQKP-UHFFFAOYSA-N

Formula

C20H16ClFN4O3

Mass

414.82

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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 - Aniline or substituted anilines - Alkyl aryl ether - Chlorobenzene - Aminopyrimidine - Halobenzene - Halopyrimidine - Aryl chloride - Monocyclic benzene moiety - Imidolactam - Benzenoid - Aryl halide - Aryl fluoride - Pyrimidine - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Ether - Secondary amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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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