Compound Identification
SMILES
CCOC(=O)C1=C2C=C(C)C=CN2C2=C(SCC3=CC=CC=C3C#N)SC(C(=O)C3=CC=CC=C3)=C12
InChIKey
InChIKey=AYOHBXNCCXWISZ-UHFFFAOYSA-N
Formula
C29H22N2O3S2
Mass
510.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Aryl-phenylketones
-
Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Aryl-phenylketones
Alternative Parents
Indolizines Thiophene carboxylic acids and derivatives Benzonitriles Benzoyl derivatives Pyrrole carboxylic acids and derivatives Alkylarylthioethers Methylpyridines Substituted pyrroles Heteroaromatic compounds Vinylogous amides Carboxylic acid esters Sulfenyl compounds Azacyclic compounds Nitriles Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl-phenylketone - Pyrrolopyridine - Indolizine - Aryl thioether - Benzonitrile - Benzoyl - Thiophene carboxylic acid or derivatives - Pyrrole-3-carboxylic acid or derivatives - Methylpyridine - Alkylarylthioether - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Pyridine - Thiophene - Heteroaromatic compound - Pyrrole - Vinylogous amide - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Carbonitrile - Nitrile - Organoheterocyclic compound - Sulfenyl compound - Thioether - Cyanide - Organic oxide - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available