Compound Identification
SMILES
CS(=O)(=O)N1CCC(CC1)C(=O)NC1=C(O)C=C(Br)C=C1C(=O)NC1=NC=C(Cl)C=C1
InChIKey
InChIKey=IUSLJUFWFCGVOO-UHFFFAOYSA-N
Formula
C19H20BrClN4O5S
Mass
531.81
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
3-halobenzoic acids and derivatives Benzamides Anilides Piperidinecarboxamides Benzoyl derivatives N-arylamides M-bromophenols 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Bromobenzenes Organosulfonamides Organic sulfonamides Imidolactams Aryl chlorides Aryl bromides Pyridines and derivatives Vinylogous amides Heteroaromatic compounds Sulfonyls Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Anilide - Piperidinecarboxamide - Benzoyl - 3-halophenol - 3-bromophenol - N-arylamide - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Bromobenzene - Halobenzene - Phenol - Aryl bromide - Aryl chloride - Aryl halide - Piperidine - Pyridine - Organic sulfonic acid amide - Organosulfonic acid amide - Imidolactam - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Vinylogous amide - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organochloride - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Organohalogen compound - Organobromide - 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