Compound Identification
SMILES
CCOC(=O)C1=CC=C(C=C1)N1C(=S)SC2=C1N=C(SCC(=O)C(C)(C)C)N(C2=O)C1=CC=CC=C1
InChIKey
InChIKey=CTLUFBJPDPWZPR-UHFFFAOYSA-N
Formula
C26H25N3O4S3
Mass
539.68
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Benzoyl derivatives Pyrimidones Alkylarylthioethers Vinylogous amides Thiazoles Heteroaromatic compounds Lactams Ketones Carboxylic acid esters Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Aryl thioether - Benzoyl - Pyrimidone - Alkylarylthioether - Pyrimidine - Azole - Heteroaromatic compound - Thiazole - Vinylogous amide - Carboxylic acid ester - Ketone - Lactam - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Thioether - Sulfenyl compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available