Compound Identification
SMILES
C[C@@H](OC(=O)C1=C(O)C=C(C)C=C1)C1=NC2=C(C(=CS2)C2=CC=CS2)C(=O)N1
InChIKey
InChIKey=UEYBDHSYAYNEBO-LLVKDONJSA-N
Formula
C20H16N2O4S2
Mass
412.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
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Level 5
Benzoic acid esters
- Level 6 o-Hydroxybenzoic acid esters
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Level 5
Benzoic acid esters
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Subclass
Benzoic acids and derivatives
-
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
Benzoic acid esters
Direct Parent
o-Hydroxybenzoic acid esters
Alternative Parents
Bi- and oligothiophenes Salicylic acid and derivatives Thienopyrimidines Benzoyl derivatives Meta cresols Pyrimidones 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Toluenes Heteroaromatic compounds Vinylogous acids Thiophenes Lactams Carboxylic acid esters Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
O-hydroxybenzoic acid ester - Bithiophene - Salicylic acid or derivatives - Thienopyrimidine - Benzoyl - M-cresol - Phenol - Pyrimidone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Toluene - Pyrimidine - Thiophene - Heteroaromatic compound - Vinylogous acid - Lactam - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as o-hydroxybenzoic acid esters. These are benzoic acid esters where the benzene ring is ortho-substituted with a hydroxy group.
External Descriptors
Not available