Compound Identification
SMILES
Br\C(\C=N\NC(=O)C(\NC(=O)C1=CC=CC=C1)=C/C1=CC=CS1)=C/C1=CC=CC=C1
InChIKey
InChIKey=BHWFYYZVSZKUCP-GFRHNOEHSA-N
Formula
C23H18BrN3O2S
Mass
480.38
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 Benzoyl derivatives Thiophenes Heteroaromatic compounds Secondary carboxylic acid amides Vinyl bromides Bromoalkenes Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzoyl - Heteroaromatic compound - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Vinyl halide - Vinyl bromide - Bromoalkene - Carboxylic acid derivative - Organoheterocyclic compound - Haloalkene - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen 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