Compound Identification
SMILES
ClC1=CC=CC(=C1)N1C(=O)\C(=C/NC2=CC=C(C=C2)S(=O)(=O)NC2=NC=CS2)C2=CC=CC=C2C1=O
InChIKey
InChIKey=MTDRAXIEVQKPJL-JCMHNJIXSA-N
Formula
C25H17ClN4O4S2
Mass
537.01
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Isoquinolines and derivatives
- Subclass 1,3-isoquinolinediones
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Class
Isoquinolines and derivatives
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Superclass
Organoheterocyclic compounds
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
Aminobenzenesulfonamides Isoquinolones and derivatives Tetrahydroisoquinolines Benzenesulfonyl compounds Aniline and substituted anilines Secondary alkylarylamines Chlorobenzenes Organosulfonamides N-substituted carboxylic acid imides Aryl chlorides Vinylogous amides Thiazoles Aminosulfonyl compounds Heteroaromatic compounds Dicarboximides Amino acids and derivatives Enamines Azacyclic compounds Organochlorides Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-isoquinolinedione - Aminobenzenesulfonamide - Isoquinolone - Benzenesulfonamide - Tetrahydroisoquinoline - Benzenesulfonyl group - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl chloride - Carboxylic acid imide, n-substituted - Benzenoid - Monocyclic benzene moiety - Aryl halide - Organosulfonic acid amide - Carboxylic acid imide - Dicarboximide - Heteroaromatic compound - Vinylogous amide - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Azole - Thiazole - Amino acid or derivatives - Enamine - Carboxylic acid derivative - Secondary amine - Azacycle - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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