Compound Identification
SMILES
CN1CCN(CCCN(C2CCC3=C(C2)C=C(NC(C)=O)C=C3)C(=O)NC2=CC(Cl)=C(F)C=C2)CC1
InChIKey
InChIKey=NDXIREGXKRWDPJ-UHFFFAOYSA-N
Formula
C27H35ClFN5O2
Mass
516.06
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Tetralins
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Tetralins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetralins
Alternative Parents
N-phenylureas N-acetylarylamines N-methylpiperazines Fluorobenzenes Chlorobenzenes Aryl chlorides Aryl fluorides Acetamides Ureas Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organofluorides Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Tetralin - N-acetylarylamine - N-arylamide - Halobenzene - Fluorobenzene - Chlorobenzene - N-methylpiperazine - N-alkylpiperazine - Aryl chloride - Aryl fluoride - 1,4-diazinane - Aryl halide - Piperazine - Monocyclic benzene moiety - Acetamide - Secondary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Urea - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organofluoride - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.
External Descriptors
Not available