Compound Identification
SMILES
CC(CC(N)=O)C(=O)C1=CC=CC2=NSN=C12
InChIKey
InChIKey=PYCNMIXRFFXOJW-UHFFFAOYSA-N
Formula
C11H11N3O2S
Mass
249.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Butyrophenones
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Butyrophenones
Intermediate Tree Nodes
Not available
Direct Parent
Butyrophenones
Alternative Parents
Benzothiadiazoles Aryl alkyl ketones Fatty amides Thiadiazoles Heteroaromatic compounds Primary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Butyrophenone - 2,1,3-benzothiadiazole - Aryl ketone - Aryl alkyl ketone - Fatty amide - Fatty acyl - Azole - Heteroaromatic compound - Thiadiazole - Carboxamide group - Ketone - Primary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as butyrophenones. These are compounds containing 1-phenylbutan-1-one moiety.
External Descriptors
Not available