Compound Identification
SMILES
CC(=O)C1=CC=C(NC(=O)CN2C(=S)SC(=CC3=CC=CS3)C2=O)C=C1
InChIKey
InChIKey=QYVYGJRMHDAIMI-UHFFFAOYSA-N
Formula
C18H14N2O3S3
Mass
402.5
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 Alkyl-phenylketones
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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
Alkyl-phenylketones
Alternative Parents
Alpha amino acids and derivatives Anilides Acetophenones N-arylamides Benzoyl derivatives Aryl alkyl ketones Thiazolidinethiones Thiophenes Heteroaromatic compounds Cyclic dithiocarbamic acid esters Secondary carboxylic acid amides Azacyclic compounds Organosulfur compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Alpha-amino acid or derivatives - Acetophenone - Anilide - N-arylamide - Aryl alkyl ketone - Benzoyl - Thiazolidinethione - Benzenoid - Monocyclic benzene moiety - Thiazolidine - Cyclic dithiocarbamic acid ester - Thiophene - Dithiocarbamic acid ester - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available