Compound Identification
SMILES
NC(=O)CNC(=O)C1=CC=CC=C1SC(=O)C1=C(C=CC=C1F)C(F)(F)F
InChIKey
InChIKey=PKOZVWYCNKAXMH-UHFFFAOYSA-N
Formula
C17H12F4N2O3S
Mass
400.35
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 Trifluoromethylbenzenes 2-halobenzoic acids and derivatives O-sulfanylbenzoic acids and derivatives Thiobenzoic acids and derivatives Aryl thioethers Benzoyl derivatives Fluorobenzenes Aryl fluorides Vinylogous halides Thioesters Secondary carboxylic acid amides Primary carboxylic acid amides Carbothioic S-esters Sulfenyl compounds Alkyl fluorides Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives Organofluorides Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Trifluoromethylbenzene - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - O-sulfanylbenzoic acid or derivatives - Thiobenzoic acid or derivatives - Aryl thioether - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Vinylogous halide - Carbothioic s-ester - Carboxamide group - Thiocarboxylic acid ester - Secondary carboxylic acid amide - Primary carboxylic acid amide - Thiocarboxylic acid or derivatives - Sulfenyl compound - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Carbonyl group - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur 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