Compound Identification
SMILES
CS(=O)(=O)CC1=NC=CN1CCCCC1=CC=C(OCC2=COC(\C=C\C3=CC(F)=C(Cl)C=C3)=N2)C=C1
InChIKey
InChIKey=HTSJFBCHSBICTK-XYOKQWHBSA-N
Formula
C27H27ClFN3O4S
Mass
544.04
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Styrenes Phenoxy compounds Phenol ethers 2,4-disubstituted oxazoles Alkyl aryl ethers Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides N-substituted imidazoles Sulfones Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbutylamine - Phenoxy compound - Phenol ether - Styrene - 2,4-disubstituted 1,3-oxazole - Alkyl aryl ether - Halobenzene - Chlorobenzene - Fluorobenzene - Aryl chloride - Aryl fluoride - N-substituted imidazole - Aryl halide - Sulfone - Oxazole - Sulfonyl - Azole - Imidazole - Heteroaromatic compound - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Organooxygen compound - Organosulfur compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Organochloride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available