Compound Identification
SMILES
OC(=O)C(F)(F)F.ClC1=C(Cl)C=C(CN2CCC(CC2)NCCCCOC2=CC=C(C=C2)C2=CSC(=N2)N2CCNCC2)C=C1
InChIKey
InChIKey=YDAWLXZAQPKBHX-UHFFFAOYSA-N
Formula
C31H38Cl2F3N5O3S
Mass
688.63
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
N-arylpiperazines Benzylamines Phenylmethylamines Phenoxy compounds Phenol ethers Dialkylarylamines Dichlorobenzenes 2,4-disubstituted thiazoles Alkyl aryl ethers Aminopiperidines Aralkylamines Aryl chlorides 2-amino-1,3-thiazoles Alpha-halocarboxylic acids Heteroaromatic compounds Trialkylamines Dialkylamines Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organochlorides Organofluorides Carbonyl compounds Alkyl fluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Not available
Substituents
N-benzylpiperidine - N-arylpiperazine - Phenoxy compound - Benzylamine - 1,2-dichlorobenzene - Dialkylarylamine - Phenol ether - Phenylmethylamine - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - 4-aminopiperidine - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - 1,3-thiazol-2-amine - Benzenoid - Piperazine - Thiazole - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid - Heteroaromatic compound - Azole - Tertiary amine - Tertiary aliphatic amine - Secondary amine - Monocarboxylic acid or derivatives - Ether - Azacycle - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Organofluoride - Hydrocarbon derivative - Alkyl fluoride - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Alkyl halide - Organohalogen compound - Amine - Organochloride - Aromatic heteromonocyclic 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