Compound Identification
SMILES
CCC(C)CNC(=O)C1=CC(SCC2=C(OC(CN3C=CN=C3)C3=CC=CC=C3)C=CC3=C2CCCC3=O)=CC=C1
InChIKey
InChIKey=PGNZHDAIDDHYQI-UHFFFAOYSA-N
Formula
C34H37N3O3S
Mass
567.75
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Tetralins
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Tetralins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetralins
Alternative Parents
M-sulfanylbenzoic acids and derivatives Benzamides Phenol ethers Thiophenol ethers Benzoyl derivatives Aryl alkyl ketones Alkyl aryl ethers Alkylarylthioethers N-substituted imidazoles Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Sulfenyl compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
M-sulfanylbenzoic acid or derivatives - Tetralin - Benzamide - Benzoic acid or derivatives - Aryl thioether - Benzoyl - Phenol ether - Thiophenol ether - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Alkylarylthioether - Monocyclic benzene moiety - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Secondary carboxylic acid amide - Carboxamide group - Ketone - Organoheterocyclic compound - Thioether - Azacycle - Sulfenyl compound - Ether - Carboxylic acid derivative - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.
External Descriptors
Not available