Compound Identification
SMILES
CCSC1=NC=C(C=O)N1CC1=CC=C(C=C1)C(O)=O
InChIKey
InChIKey=AXYVRBXXYYWEAI-UHFFFAOYSA-N
Formula
C14H14N2O3S
Mass
290.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
-
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
Imidazolyl carboxylic acids and derivatives Benzoyl derivatives 1,2,5-trisubstituted imidazoles Carbonylimidazoles Aryl-aldehydes Alkylarylthioethers N-substituted imidazoles Heteroaromatic compounds Sulfenyl compounds Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoic acid - 1,2,5-trisubstituted-imidazole - Aryl thioether - Benzoyl - Imidazolyl carboxylic acid derivative - Trisubstituted imidazole - Imidazole-4-carbonyl group - Alkylarylthioether - Aryl-aldehyde - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Sulfenyl compound - Thioether - Aldehyde - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic 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