Compound Identification
SMILES
COC1=NC(=NC(OC2=C(C=C)C=C(C=C2)C(NC(=O)NC(C)(C)C)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=KGGMDNMLGKIVRP-UHFFFAOYSA-N
Formula
C40H37F3N6O7S
Mass
802.83
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-carbamoyl-alpha amino acids and derivatives Alpha amino acid amides Diarylethers Trifluoromethylbenzenes Benzenesulfonamides Phenylacetamides Anilides Benzenesulfonyl compounds Styrenes Benzoyl derivatives Phenoxy compounds N-arylamides Phenol ethers Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Aminosulfonyl compounds Heteroaromatic compounds Organosulfonic acids and derivatives Ureas Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organic oxides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-carbamoyl-alpha-amino acid or derivatives - Acylaminobenzoic acid or derivatives - Alpha-amino acid amide - Diaryl ether - Phenylacetamide - Benzenesulfonamide - Alpha-amino acid or derivatives - N-substituted-alpha-amino acid - Trifluoromethylbenzene - Anilide - Benzenesulfonyl group - Benzoyl - Phenoxy compound - Phenol ether - N-arylamide - Styrene - Alkyl aryl ether - Pyrimidine - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Heteroaromatic compound - Urea - Secondary carboxylic acid amide - Carboxamide group - Carbonic acid derivative - Carboxylic acid derivative - Azacycle - Ether - Organoheterocyclic compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Alkyl halide - Alkyl fluoride - 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