Compound Identification
SMILES
O=C[C@H]1NCCC1C(=O)[C@H]1NCC(=S)C1C(=O)C1=CC2=CC=CC=C2C1
InChIKey
InChIKey=NLEKGZDBOKEDRZ-NRLXWARBSA-N
Formula
C20H20N2O3S
Mass
368.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Indenes and isoindenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indenes and isoindenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Indenes and isoindenes
Alternative Parents
Gamma-amino ketones Beta-amino ketones Pyrrolidines Alpha-amino ketones Thioketones Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indene - Beta-aminoketone - Gamma-aminoketone - Alpha-aminoketone - Pyrrolidine - Thioketone - Ketone - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Secondary amine - Aldehyde - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Thiocarbonyl group - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indenes and isoindenes. These are compounds containing an indene moiety(which consists of a cyclopentadiene fused to a benzene ring), or a isoindene moiety (which consists of a cyclopentadiene fused to cyclohexadiene ring).
External Descriptors
Not available