Compound Identification
SMILES
CC1=CC=CC(=C1)C(=O)NCC(=O)NNC(=O)CSC1=C(Cl)C=CC(Cl)=C1
InChIKey
InChIKey=IKGMQPSUYGFKDE-UHFFFAOYSA-N
Formula
C18H17Cl2N3O3S
Mass
426.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
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Level 5
Benzamides
- Level 6 Hippuric acids and derivatives
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Level 5
Benzamides
-
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
Benzamides
Direct Parent
Hippuric acids and derivatives
Alternative Parents
N-acyl-alpha amino acids and derivatives m-Toluamides Thiophenol ethers Dichlorobenzenes Benzoyl derivatives Alkylarylthioethers Diacylhydrazines Aryl chlorides Secondary carboxylic acid amides Sulfenyl compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - M-toluamide - Toluamide - Aryl thioether - Benzoyl - Thiophenol ether - 1,4-dichlorobenzene - Halobenzene - Alkylarylthioether - Toluene - Chlorobenzene - Diacylhydrazine - Aryl chloride - Aryl halide - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid hydrazide - Sulfenyl compound - Thioether - Carboxylic acid derivative - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.
External Descriptors
Not available