Compound Identification
SMILES
COC1=C(C(=O)NC(C2=CC=CC=C2)C2(CC2)N2CCCC2)C(SC)=CC(=C1)C(F)(F)F
InChIKey
InChIKey=MDYKBRMFNQTHJH-UHFFFAOYSA-N
Formula
C24H27F3N2O2S
Mass
464.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
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Level 5
Benzamides
- Level 6 N-benzylbenzamides
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Level 5
Benzamides
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Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Benzamides
Direct Parent
N-benzylbenzamides
Alternative Parents
Trifluoromethylbenzenes O-sulfanylbenzoic acids and derivatives Thiophenol ethers Anisoles Phenoxy compounds Benzoyl derivatives Methoxybenzenes Alkyl aryl ethers Alkylarylthioethers Aralkylamines Vinylogous thioesters N-alkylpyrrolidines Secondary carboxylic acid amides Amino acids and derivatives Trialkylamines Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organofluorides Organic oxides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-benzylbenzamide - Trifluoromethylbenzene - O-sulfanylbenzoic acid or derivatives - Phenoxy compound - Aryl thioether - Anisole - Benzoyl - Phenol ether - Methoxybenzene - Thiophenol ether - Alkyl aryl ether - Aralkylamine - Alkylarylthioether - Vinylogous thioester - N-alkylpyrrolidine - Pyrrolidine - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Ether - Organosulfur compound - Organohalogen compound - Hydrocarbon derivative - Organofluoride - Organonitrogen compound - Alkyl fluoride - Organic oxide - Organic oxygen compound - Alkyl halide - Amine - Organooxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-benzylbenzamides. These are compounds containing a benzamide moiety that is N-linked to a benzyl group.
External Descriptors
Not available