Compound Identification
SMILES
CC(C)N1CC(C(=O)C1=O)C1=NC=C(C=C1)S(=O)C1=CC=C(F)C=C1
InChIKey
InChIKey=KFJGKUZYGCMFNB-UHFFFAOYSA-N
Formula
C18H17FN2O3S
Mass
360.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenyl sulfoxides
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenyl sulfoxides
Intermediate Tree Nodes
Not available
Direct Parent
Phenyl sulfoxides
Alternative Parents
Fluorobenzenes Aryl fluorides N-alkylpyrrolidines Pyrrolidine-3-ones Pyrrolidine-2-ones Pyridines and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Lactams Sulfoxides Cyclic ketones Sulfinyl compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl sulfoxide - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Pyridine - Pyrrolidone - N-alkylpyrrolidine - 2-pyrrolidone - 3-pyrrolidone - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Lactam - Cyclic ketone - Sulfoxide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl sulfoxides. These are organosulfur compounds containing a sulfoxide group substituted with a phenyl group.
External Descriptors
Not available