Compound Identification
SMILES
CC1=CC(=CC(C)=C1)C1=NN=C(O1)C(S)C1=CC=C(C=C1)C(O)=O
InChIKey
InChIKey=DHIUSAHGYYMIHZ-UHFFFAOYSA-N
Formula
C18H16N2O3S
Mass
340.4
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
m-Xylenes Benzoyl derivatives Heteroaromatic compounds 1,3,4-oxadiazoles Oxacyclic compounds Carboxylic acids Azacyclic compounds Alkylthiols Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoic acid - Benzoyl - Xylene - M-xylene - 1,3,4-oxadiazole - Azole - Oxadiazole - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Oxacycle - Alkylthiol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - 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