Compound Identification
SMILES
CC1=CC(NC(=S)N2CCC3(CCN(C3)C(=O)C3=CC=C(Br)O3)CC2)=CC(C)=C1
InChIKey
InChIKey=ZJIQSMQWTFJOTR-UHFFFAOYSA-N
Formula
C22H26BrN3O2S
Mass
476.43
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
N-phenylthioureas m-Xylenes 2-heteroaryl carboxamides Furoic acid and derivatives N-acylpyrrolidines Piperidines Aryl bromides Tertiary carboxylic acid amides Heteroaromatic compounds Thioureas Oxacyclic compounds Azacyclic compounds Organobromides Organonitrogen compounds Organooxygen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Azaspirodecane - N-phenylthiourea - 2-heteroaryl carboxamide - Furoic acid or derivatives - M-xylene - Xylene - N-acylpyrrolidine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Piperidine - Benzenoid - Furan - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Thiourea - Oxacycle - Carboxylic acid derivative - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - 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