Compound Identification
SMILES
CCOC(=O)C1=C(C)N(C)C2=C1C(NC(=O)CCN1CCSCC1)=C(OC)C=C2
InChIKey
InChIKey=DWDHSAAOHLDDKE-UHFFFAOYSA-N
Formula
C21H29N3O4S
Mass
419.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- 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 and derivatives
Alternative Parents
Beta amino acids and derivatives N-alkylindoles Methoxyanilines Indoles Pyrrole carboxylic acids and derivatives Anisoles N-arylamides Alkyl aryl ethers Thiomorpholines N-methylpyrroles Vinylogous amides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Dialkylthioethers Organic oxides Carbonyl compounds Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid derivative - Beta amino acid or derivatives - N-alkylindole - Indole - Methoxyaniline - Anisole - Pyrrole-3-carboxylic acid or derivatives - N-arylamide - Alkyl aryl ether - N-methylpyrrole - Benzenoid - 1,4-thiazinane - Substituted pyrrole - Heteroaromatic compound - Vinylogous amide - Pyrrole - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Tertiary aliphatic amine - Secondary carboxylic acid amide - Tertiary amine - Azacycle - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Dialkylthioether - Thioether - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Amine - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole.
External Descriptors
Not available