Compound Identification
SMILES
CC1=C(C=C(NC2=CC=CC3=C2CCN(C3)S(C)(=O)=O)C=C1)C1=CC=C(CC#N)C=C1
InChIKey
InChIKey=OUGYQJOXWONQCZ-UHFFFAOYSA-N
Formula
C25H25N3O2S
Mass
431.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Biphenyls and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Biphenyls and derivatives
Alternative Parents
Tetrahydroisoquinolines Benzyl cyanides Aniline and substituted anilines Aminotoluenes Primary aromatic amines Organosulfonamides Organic sulfonamides Sulfonyls Secondary amines Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biphenyl - Tetrahydroisoquinoline - Benzyl-cyanide - Aniline or substituted anilines - Aminotoluene - Toluene - Primary aromatic amine - Organic sulfonic acid amide - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Secondary amine - Amine - Organosulfur compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond.
External Descriptors
Not available