Compound Identification
SMILES
COC1=NC=CC(CNC(=O)C2=NC3=C(S2)N(C)C=C(CC2=CC=C(C=C2)C(O)=O)C3=O)=C1
InChIKey
InChIKey=UIYWAVMWDPMKMK-UHFFFAOYSA-N
Formula
C23H20N4O5S
Mass
464.5
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 acids
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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 acids
Alternative Parents
Thiazolecarboxamides Benzoyl derivatives 2-heteroaryl carboxamides Alkyl aryl ethers Pyridines and derivatives Vinylogous amides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoic acid - 2-heteroaryl carboxamide - Benzoyl - Thiazolecarboxylic acid or derivatives - Thiazolecarboxamide - Alkyl aryl ether - Pyridine - Azole - Heteroaromatic compound - Vinylogous amide - Thiazole - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl group.
External Descriptors
Not available