Compound Identification
SMILES
ClC1=CC=C(C=C1)C1=NOC2C3OC(C4C3C(=O)N(C4=O)C3=NC=CS3)C12
InChIKey
InChIKey=DUPFLTHWEYIMSV-UHFFFAOYSA-N
Formula
C18H12ClN3O4S
Mass
401.82
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Isoindoles and derivatives
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Subclass
Isoindolines
- Level 5 Isoindolones
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Subclass
Isoindolines
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Class
Isoindoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoindoles and derivatives
Subclass
Isoindolines
Intermediate Tree Nodes
Not available
Direct Parent
Isoindolones
Alternative Parents
Chlorobenzenes Aryl chlorides Pyrrolidine-2-ones N-substituted carboxylic acid imides Thiazoles Dicarboximides Heteroaromatic compounds Isoxazolines Oxolanes Amino acids and derivatives Lactams Tertiary amines Azacyclic compounds Dialkyl ethers Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoindolone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - Pyrrolidone - 2-pyrrolidone - Azole - Carboxylic acid imide - Dicarboximide - Heteroaromatic compound - Isoxazoline - Oxolane - Pyrrolidine - Thiazole - Tertiary amine - Lactam - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organic oxide - Amine - Organic nitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoindolones. These are aromatic polycyclic compounds that an isoindole bearing a ketone.
External Descriptors
Not available