Compound Identification
SMILES
OC(=O)C(F)(F)F.O=C1NC2=CC=CC=C2N1C1CCN(CC2=CC=C(C=C2)C2=C(N=NC(=N2)C2=NC=CS2)C2=CC=CC=C2)CC1
InChIKey
InChIKey=GAHPDAHSTIAYTE-UHFFFAOYSA-N
Formula
C33H28F3N7O3S
Mass
659.69
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Piperidines
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Subclass
Benzylpiperidines
- Level 5 N-benzylpiperidines
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Subclass
Benzylpiperidines
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Class
Piperidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Benzylpiperidines
Intermediate Tree Nodes
Not available
Direct Parent
N-benzylpiperidines
Alternative Parents
Benzimidazoles Phenylmethylamines Benzylamines Aralkylamines 1,2,4-triazines N-substituted imidazoles Thiazoles Alpha-halocarboxylic acids Heteroaromatic compounds Ureas Trialkylamines Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Alkyl fluorides Organofluorides Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Not available
Substituents
N-benzylpiperidine - Benzimidazole - Benzylamine - Phenylmethylamine - Aralkylamine - Monocyclic benzene moiety - N-substituted imidazole - Triazine - Benzenoid - 1,2,4-triazine - Heteroaromatic compound - Alpha-halocarboxylic acid or derivatives - Azole - Imidazole - Thiazole - Alpha-halocarboxylic acid - Tertiary aliphatic amine - Urea - Tertiary amine - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Organonitrogen compound - Amine - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Alkyl fluoride - Alkyl halide - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-benzylpiperidines. These are heterocyclic Compounds containing a piperidine ring conjugated to a benzyl group through one nitrogen ring atom.
External Descriptors
Not available