Compound Identification
SMILES
FC1=C(F)C=C(NC(=O)N2CCC3(CC2)SCCN3C(=O)C2=CC=C(Br)C=C2)C=C1
InChIKey
InChIKey=UZNBDQGXZKBEKR-UHFFFAOYSA-N
Formula
C21H20BrF2N3O2S
Mass
496.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azaspirodecane derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Azaspirodecane derivatives
Alternative Parents
4-halobenzoic acids and derivatives N-phenylureas Piperidinecarboxamides Benzamides Benzoyl derivatives Fluorobenzenes Bromobenzenes Aryl bromides Aryl fluorides Thiazolidines Tertiary carboxylic acid amides Ureas Thiohemiaminal derivatives Azacyclic compounds Dialkylthioethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Azaspirodecane - 1-piperidinecarboxamide - Piperidinecarboxamide - Benzoic acid or derivatives - Benzamide - Benzoyl - Fluorobenzene - Bromobenzene - Halobenzene - Aryl fluoride - Piperidine - Aryl halide - Benzenoid - Monocyclic benzene moiety - Aryl bromide - Thiazolidine - Tertiary carboxylic acid amide - Urea - Carboxamide group - Carboxylic acid derivative - Thioether - Hemithioaminal - Dialkylthioether - Azacycle - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organobromide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as azaspirodecane derivatives. These are organic compounds containing a spirodecane moiety with at least one nitrogen atom.
External Descriptors
Not available