Compound Identification
SMILES
CC(C)[C@H](NC(=O)C1=CC=C(F)C=C1)C(=O)N1CCN(CC1)S(=O)(=O)C1=CC=C(C=C1)C#N
InChIKey
InChIKey=IPGNWVMFGWJGEN-NRFANRHFSA-N
Formula
C23H25FN4O4S
Mass
472.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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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
Valine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides 4-halobenzoic acids and derivatives Benzenesulfonamides Benzenesulfonyl compounds Benzoyl derivatives Benzonitriles Fluorobenzenes Organosulfonamides Aryl fluorides Piperazines Tertiary carboxylic acid amides Sulfonyls Secondary carboxylic acid amides Tertiary amines Nitriles Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Valine or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - 4-halobenzoic acid or derivatives - Benzenesulfonamide - Halobenzoic acid or derivatives - Benzenesulfonyl group - Benzonitrile - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - 1,4-diazinane - Organosulfonic acid amide - Piperazine - Aryl halide - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid or derivatives - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Nitrile - Carbonitrile - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organofluoride - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organooxygen compound - Organonitrogen compound - Organohalogen 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