Compound Identification
SMILES
[Na+].CC(C)(C)CCC1=CN(C2=NC(=CS2)C([O-])=O)C2=C1C=CC(Cl)=C2
InChIKey
InChIKey=YEVHYDRNFKHDSY-UHFFFAOYSA-M
Formula
C18H18ClN2NaO2S
Mass
384.85
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indoles
- Level 5 3-alkylindoles
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Subclass
Indoles
-
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
3-alkylindoles
Alternative Parents
Thiazolecarboxylic acids and derivatives 2,4-disubstituted thiazoles Substituted pyrroles Aryl chlorides Benzenoids Heteroaromatic compounds Carboxylic acid salts Azacyclic compounds Carboxylic acids Organic metal halides Organic sodium salts Organonitrogen compounds Organic zwitterions Organochlorides Hydrocarbon derivatives Organooxygen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Aryl chloride - Aryl halide - Substituted pyrrole - Benzenoid - Azole - Heteroaromatic compound - Pyrrole - Thiazole - Carboxylic acid salt - Organic metal halide - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic alkali metal salt - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic sodium salt - Organic salt - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.
External Descriptors
Not available