Compound Identification
SMILES
O=C(NCC1=CC=CS1)C1=CC=C(C=C1)C1=C(C#N)C(=O)C2=CC=CC=C12
InChIKey
InChIKey=VRFQDGKIYVZOHC-UHFFFAOYSA-N
Formula
C22H14N2O2S
Mass
370.43
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
Benzamides Benzoyl derivatives Aryl ketones Thiophenes Heteroaromatic compounds Secondary carboxylic acid amides Nitriles Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzamide - Benzoic acid or derivatives - Indene - Benzoyl - Aryl ketone - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Ketone - Carboxylic acid derivative - Organoheterocyclic compound - Carbonitrile - Nitrile - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Cyanide - Organonitrogen 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