Compound Identification
SMILES
COC(=O)C1=CC=C(C=C1)C(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)NCCO
InChIKey
InChIKey=DQJZIAURTWPXNF-UHFFFAOYSA-N
Formula
C19H17N3O5S
Mass
399.42
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
Benzothiazoles Benzamides N-acylethanolamines Benzoyl derivatives Thiazoles Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Benzamide - 1,3-benzothiazole - Benzoyl - N-acylethanolamine - Azole - Heteroaromatic compound - Methyl ester - Thiazole - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Alkanolamine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - 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