Compound Identification
SMILES
CCC(=S)NC[C@H]1CN(C(=O)O1)C1=CC(F)=C(C=C1)N1CCN(CC1)C(=O)COC(=O)C1=CC=C(NC(=O)CN)C=C1
InChIKey
InChIKey=GWZMXUIEQROGJB-NRFANRHFSA-N
Formula
C28H33FN6O6S
Mass
600.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
Alpha amino acid amides Phenylpiperazines N-arylpiperazines Benzoic acid esters Anilides Aniline and substituted anilines Benzoyl derivatives Dialkylarylamines N-arylamides Fluorobenzenes Aryl fluorides Oxazolidinones Carbamate esters Tertiary carboxylic acid amides Thioamides Carboxylic acid esters Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Thiocarboxylic acid amides Monoalkylamines Hydrocarbon derivatives Thiocarbonyl compounds Carbonyl compounds Organofluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Alpha-amino acid amide - Phenylpiperazine - N-arylpiperazine - Alpha-amino acid or derivatives - Benzoate ester - Anilide - Aniline or substituted anilines - Dialkylarylamine - Benzoyl - N-arylamide - Tertiary aliphatic/aromatic amine - Halobenzene - Fluorobenzene - Aryl fluoride - Oxazolidinone - Aryl halide - Piperazine - 1,4-diazinane - Carbamic acid ester - Oxazolidine - Tertiary carboxylic acid amide - Thioamide - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Carboxylic acid ester - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Thiocarboxylic acid amide - Carboxylic acid derivative - Organosulfur compound - Primary amine - Thiocarbonyl group - Hydrocarbon derivative - Carbonyl group - Amine - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Primary aliphatic amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available