Compound Identification
SMILES
FC1=CC=C(C=C1)C1=CSC(NC(=O)CNC(=O)C2=CC=CC=C2Cl)=N1
InChIKey
InChIKey=QWOYSMYGXUYMLI-UHFFFAOYSA-N
Formula
C18H13ClFN3O2S
Mass
389.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
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 Alpha amino acid amides 2-halobenzoic acids and derivatives Benzoyl derivatives N-arylamides 2,4-disubstituted thiazoles Chlorobenzenes Fluorobenzenes Aryl fluorides Aryl chlorides Heteroaromatic compounds Vinylogous halides Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Organofluorides Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoyl - N-arylamide - 2,4-disubstituted 1,3-thiazole - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Vinylogous halide - Azole - Heteroaromatic compound - Thiazole - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Carbonyl group - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organic oxide - Organofluoride - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic 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