Compound Identification
SMILES
CCOC(=O)C1=C(C2=C(S1)C=C(OCC1=CC=CC(=C1)C#N)C=C2)S(=O)C1=CC=CC=C1
InChIKey
InChIKey=SUEMGHACOLQAGV-UHFFFAOYSA-N
Formula
C25H19NO4S2
Mass
461.55
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
1-benzothiophenes Thiophene carboxylic acids and derivatives Phenol ethers Benzonitriles Alkyl aryl ethers Heteroaromatic compounds Sulfoxides Carboxylic acid esters Sulfinyl compounds Nitriles Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl sulfoxide - Benzothiophene - 1-benzothiophene - Benzonitrile - Phenol ether - Thiophene carboxylic acid or derivatives - Alkyl aryl ether - Heteroaromatic compound - Thiophene - Carboxylic acid ester - Sulfoxide - Carboxylic acid derivative - Ether - Carbonitrile - Nitrile - Organoheterocyclic compound - Sulfinyl compound - Cyanide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic 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