Compound Identification
SMILES
CCOC(=O)N1CCC(CC1)SC1=CNC2=C1C=C(Br)C=C2
InChIKey
InChIKey=KPJWNCOUGWNWTB-UHFFFAOYSA-N
Formula
C16H19BrN2O2S
Mass
383.3
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
- Subclass Indoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
Indoles
Alternative Parents
Piperidinecarboxylic acids Alkylarylthioethers Substituted pyrroles Benzenoids Aryl bromides Heteroaromatic compounds Carbamate esters Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole - Piperidinecarboxylic acid - Aryl thioether - Alkylarylthioether - Aryl bromide - Aryl halide - Piperidine - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Carbamic acid ester - Azacycle - Sulfenyl compound - Thioether - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
External Descriptors
Not available