Compound Identification
SMILES
CC1=CC=CC(C)=C1N\C=C1\C(=O)N(C2=NC=CS2)C(=O)C2=CC=CC=C12
InChIKey
InChIKey=GZXAPEZOECZDCC-SFQUDFHCSA-N
Formula
C21H17N3O2S
Mass
375.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoquinolines and derivatives
- Subclass 1,3-isoquinolinediones
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Class
Isoquinolines and derivatives
-
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
Isoquinolones and derivatives Tetrahydroisoquinolines m-Xylenes Aniline and substituted anilines Secondary alkylarylamines N-substituted carboxylic acid imides Thiazoles Heteroaromatic compounds Dicarboximides Vinylogous amides Amino acids and derivatives Enamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-isoquinolinedione - Isoquinolone - Tetrahydroisoquinoline - Aniline or substituted anilines - Xylene - M-xylene - Secondary aliphatic/aromatic amine - Carboxylic acid imide, n-substituted - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Carboxylic acid imide - Vinylogous amide - Thiazole - Azole - Dicarboximide - Amino acid or derivatives - Carboxylic acid derivative - Azacycle - Secondary amine - Enamine - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen 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