You are using an unsupported browser. Please upgrade your browser to a newer version to get the best experience on ClassyFire.
Structure Information
Structure

Compound Identification

SMILES

CC1=C(CN2CCC3=C(C=C(OC(C)(C)C(O)=O)C=C3)C2=O)SC(=N1)C1=CC=C(C=C1)C(F)(F)F

InChIKey

InChIKey=WXUPQNIHQJFBQV-UHFFFAOYSA-N

Formula

C25H23F3N2O4S

Mass

504.52

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoquinolines and derivatives

Subclass

Isoquinolones and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Isoquinolones and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoquinolone - Phenoxyacetate - Trifluoromethylbenzene - Tetrahydroisoquinoline - 2,4,5-trisubstituted 1,3-thiazole - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Ether - Azacycle - Organooxygen compound - Organic oxygen compound - Organohalogen compound - Organofluoride - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl fluoride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoquinolones and derivatives. These are aromatic polycyclic compounds containing a ketone bearing isoquinoline moiety.

External Descriptors

Not available

Previous Back Next