Compound Identification
SMILES
CC(=O)C1=C(OC(=O)C2=CC=CC=C2)C2=C(S1)N(C(=S)N(C2=O)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=USYGJPYRCPTZKE-UHFFFAOYSA-N
Formula
C27H18N2O4S2
Mass
498.57
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
-
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
Thienopyrimidines Aryl alkyl ketones Benzoyl derivatives Pyrimidinethiones Pyrimidones Vinylogous amides Heteroaromatic compounds Thiophenes Lactams Carboxylic acid esters Thioureas Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Thienopyrimidine - Benzoyl - Aryl alkyl ketone - Aryl ketone - Pyrimidinethione - Pyrimidone - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Thiophene - Carboxylic acid ester - Ketone - Lactam - Thiourea - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen 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