Structure Information
Structure

Compound Identification

SMILES

CNC1=C(Cl)C=C2C(CC(=O)N(C2=O)C2=NC=C(NC(=O)NS(=O)(=O)C3=CC=C(F)S3)C=C2)=C1

InChIKey

InChIKey=JNFIDSPVEFGUHU-UHFFFAOYSA-N

Formula

C20H15ClFN5O5S2

Mass

523.94

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoquinolines and derivatives

Subclass

1,3-isoquinolinediones

Intermediate Tree Nodes

Not available

Direct Parent

1,3-isoquinolinediones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1,3-isoquinolinedione - Isoquinolone - Tetrahydroisoquinoline - 2,5-disubstituted thiophene - Secondary aliphatic/aromatic amine - Sulfonylurea - Aryl chloride - Aryl fluoride - Aryl halide - Carboxylic acid imide, n-substituted - Pyridine - Imidolactam - Benzenoid - Carboxylic acid imide - Dicarboximide - Heteroaromatic compound - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Thiophene - Amino acid or derivatives - Secondary amine - Azacycle - Carboxylic acid derivative - Carbonyl group - Organohalogen compound - Organochloride - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organofluoride - Organosulfur compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1,3-isoquinolinediones. These are isoquinoline derivatives carrying one C=O group at positions 1, and 3 respectively.

External Descriptors

Not available

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