Compound Identification
SMILES
COC(=O)C1=CC=CC=C1NC(=S)N1CCC(O)(CC1)C1=CC=C(Br)C=C1
InChIKey
InChIKey=WBKWNZALALEFKP-UHFFFAOYSA-N
Formula
C20H21BrN2O3S
Mass
449.36
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Piperidines
- Subclass Phenylpiperidines
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Class
Piperidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Phenylpiperidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpiperidines
Alternative Parents
N-phenylthioureas Benzoic acid esters Benzoyl derivatives Bromobenzenes Aryl bromides Vinylogous amides Tertiary alcohols Methyl esters Thioureas Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpiperidine - Benzoate ester - N-phenylthiourea - Benzoic acid or derivatives - Benzoyl - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Methyl ester - Tertiary alcohol - Thiourea - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organobromide - Organohalogen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpiperidines. These are compounds containing a phenylpiperidine skeleton, which consists of a piperidine bound to a phenyl group.
External Descriptors
Not available