Compound Identification
SMILES
CC(=O)N1CCN(CC2=CC3=C(C[C@H](CC3)N3C=NC4=C(SC(=C4)C4=CC(F)=CC(F)=C4)C3=O)C=C2)CC1
InChIKey
InChIKey=MKNFVLXNENLVQQ-VWLOTQADSA-N
Formula
C29H28F2N4O2S
Mass
534.63
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
Thienopyrimidines 2,3,5-trisubstituted thiophenes Pyrimidones N-alkylpiperazines Fluorobenzenes Aralkylamines Aryl fluorides Tertiary carboxylic acid amides Acetamides Heteroaromatic compounds Trialkylamines Lactams Amino acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetralin - Thienopyrimidine - 2,3,5-trisubstituted thiophene - Fluorobenzene - Halobenzene - Pyrimidone - N-alkylpiperazine - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Pyrimidine - Tertiary carboxylic acid amide - Acetamide - Thiophene - Heteroaromatic compound - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Lactam - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic oxygen compound - Organohalogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - 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