Compound Identification
SMILES
COC1=C(C)C=CC(=C1)C(CCCN1CCOCC1)C1=NNC(=S)N1C1=CC(Cl)=C(Cl)C=C1C(F)(F)F
InChIKey
InChIKey=ZDFXXIXPEKBVML-UHFFFAOYSA-N
Formula
C25H27Cl2F3N4O2S
Mass
575.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
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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
Phenyl-1,2,4-triazoles Trifluoromethylbenzenes Aromatic monoterpenoids Monocyclic monoterpenoids Anisoles Dichlorobenzenes Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Aralkylamines Toluenes Morpholines Aryl chlorides Heteroaromatic compounds Triazolines Trialkylamines Dialkyl ethers Azacyclic compounds Oxacyclic compounds Organofluorides Organochlorides Hydrocarbon derivatives Alkyl fluorides Organosulfur compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbutylamine - Phenyltriazole - Phenyl-1,2,4-triazole - P-cymene - Trifluoromethylbenzene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Anisole - Phenoxy compound - 1,2-dichlorobenzene - Phenol ether - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aralkylamine - Toluene - Oxazinane - Aryl chloride - Aryl halide - Morpholine - 1,2,4-triazole - Triazole - Triazoline - Azole - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Dialkyl ether - Ether - Oxacycle - Amine - Alkyl fluoride - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organosulfur compound - Alkyl halide - Organohalogen compound - Organic nitrogen compound - 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