Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)C(=O)NC(=S)N1CCN(CC2=CC=CC=C2)CC1
InChIKey
InChIKey=KUKHSUUTYRDRDY-UHFFFAOYSA-N
Formula
C22H27N3O4S
Mass
429.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acids and derivatives
Alternative Parents
Phenylmethylamines Phenoxy compounds Methoxybenzenes Benzylamines Benzoyl derivatives Anisoles N-alkylpiperazines Aralkylamines Alkyl aryl ethers Trialkylamines Thioureas Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoic acid or derivatives - Anisole - Benzoyl - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Phenoxy compound - N-alkylpiperazine - Alkyl aryl ether - Aralkylamine - Piperazine - 1,4-diazinane - Tertiary aliphatic amine - Thiourea - Tertiary amine - Amino acid or derivatives - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acids and derivatives. These are organic compounds containing a carboxylic acid substituent attached to a benzene ring.
External Descriptors
Not available