Compound Identification
SMILES
COC1=CC=C(C=C1)C1=CC(=NC(SC2CC(=O)N(C2=O)C2=CC=C(C=C2)C(=O)OCC(=O)C2=CC=CC=C2OC)=C1C#N)C1=CC=CC=C1
InChIKey
InChIKey=OMVXJFMERYULGX-UHFFFAOYSA-N
Formula
C39H29N3O7S
Mass
683.74
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
Alkyl-phenylketones Phenylpyridines Phenylpyrrolidines Benzoic acid esters Anisoles Aryl alkyl ketones Benzoyl derivatives Methoxybenzenes 3-pyridinecarbonitriles Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Pyrrolidine-2-ones N-substituted carboxylic acid imides Heteroaromatic compounds Dicarboximides Pyrroles Lactams Carboxylic acid esters Azacyclic compounds Nitriles Sulfenyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Acylaminobenzoic acid or derivatives - 4-phenylpyridine - 2-phenylpyridine - 1-phenylpyrrolidine - Benzoate ester - Phenylketone - Phenoxy compound - Aryl thioether - Aryl ketone - Aryl alkyl ketone - Phenol ether - 3-pyridinecarbonitrile - Methoxybenzene - Anisole - Benzoyl - Alkylarylthioether - Alkyl aryl ether - Pyrrolidone - 2-pyrrolidone - Carboxylic acid imide, n-substituted - Pyridine - Pyrrolidine - Heteroaromatic compound - Dicarboximide - Pyrrole - Carboxylic acid imide - Carboxylic acid ester - Ketone - Lactam - Thioether - Sulfenyl compound - Organoheterocyclic compound - Nitrile - Carbonitrile - Azacycle - Carboxylic acid derivative - Ether - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Cyanide - Organopnictogen compound - Organonitrogen compound - Organooxygen 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