Compound Identification
SMILES
CCNC1=NC(=CS1)C1=C(C2CCCC2)C2=C(C=C(C=C2)C(O)=O)N1C
InChIKey
InChIKey=GQIQTAFPEBBFOQ-UHFFFAOYSA-N
Formula
C20H23N3O2S
Mass
369.48
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indolecarboxylic acids and derivatives
- Level 5 Indolecarboxylic acids
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Subclass
Indolecarboxylic acids and derivatives
-
Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indolecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indolecarboxylic acids
Alternative Parents
N-alkylindoles 3-alkylindoles Secondary alkylarylamines 2,4-disubstituted thiazoles N-methylpyrroles Benzenoids 2-amino-1,3-thiazoles Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid - N-alkylindole - 3-alkylindole - Indole - 2,4-disubstituted 1,3-thiazole - Secondary aliphatic/aromatic amine - N-methylpyrrole - Substituted pyrrole - Benzenoid - 1,3-thiazol-2-amine - Thiazole - Pyrrole - Azole - Heteroaromatic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolecarboxylic acids. These are compounds containing a carboxylic acid group linked to an indole.
External Descriptors
Not available