Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC2=C(C=C1)C(C#N)=C1SC3=C(C=C(C=C3)C(F)(F)F)N1C2=O

InChIKey

InChIKey=SXFYPFFQFJKEKK-UHFFFAOYSA-N

Formula

C17H6F3N3O3S

Mass

389.31

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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 - 1,3-benzothiazole - Nitroaromatic compound - Pyridinone - Pyridine - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Lactam - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carbonitrile - Nitrile - Organic oxoazanium - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Alkyl halide - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - 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

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