Compound Identification
SMILES
COC1=NC(=NC(OC2=C(C=C)C=C(C=C2)C(NC(=O)C2=CN=CC=C2)C(=O)NC2=CC=CC(=C2)C(=O)NS(=O)(=O)C2=CC=C(C=C2)C(F)(F)F)=C1)C1=CC=CC=C1
InChIKey
InChIKey=FUJJNJHAKGEYNE-UHFFFAOYSA-N
Formula
C41H31F3N6O7S
Mass
808.79
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
N-acyl-alpha amino acids and derivatives Alpha amino acid amides Diarylethers Trifluoromethylbenzenes Benzenesulfonamides Phenylacetamides Anilides Benzenesulfonyl compounds Nicotinamides Phenoxy compounds Phenol ethers Benzoyl derivatives Styrenes N-arylamides Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Aminosulfonyl compounds Organosulfonic acids and derivatives Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Alkyl fluorides Hydrocarbon derivatives Organofluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Acylaminobenzoic acid or derivatives - Alpha-amino acid amide - Diaryl ether - Trifluoromethylbenzene - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzenesulfonamide - Phenylacetamide - Nicotinamide - Benzenesulfonyl group - Anilide - Pyridine carboxylic acid or derivatives - Phenoxy compound - Phenol ether - Benzoyl - Styrene - N-arylamide - Alkyl aryl ether - Pyrimidine - Pyridine - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organooxygen compound - Alkyl halide - Organosulfur compound - Carbonyl group - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organofluoride - Organohalogen 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