Structure Information
Structure

Compound Identification

SMILES

BrC1=CSC(C=C2C(=O)N(CC3=CC4=C(OCO4)C=C3)C(=O)C3=CC=CC=C23)=C1

InChIKey

InChIKey=ASQOKFIYQPLDNO-UHFFFAOYSA-N

Formula

C22H14BrNO4S

Mass

468.32

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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 - Benzodioxole - Aryl bromide - Aryl halide - Benzenoid - Carboxylic acid imide, n-substituted - Heteroaromatic compound - Thiophene - Carboxylic acid imide - Dicarboximide - Acetal - Oxacycle - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - 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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