Compound Identification
SMILES
O=C(CCN1C(=O)C2=CC=CC=C2C1=O)O[C@H]1CSC[C@@H]1NC(=O)C1=CC=CC=C1
InChIKey
InChIKey=BZSLCHGJWXNMDJ-ROUUACIJSA-N
Formula
C22H20N2O5S
Mass
424.47
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
Indolyl carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indolyl carboxylic acids and derivatives
Alternative Parents
Phthalimides Isoindoles Indoles Benzamides Benzoyl derivatives N-substituted carboxylic acid imides Thiolanes Tertiary amines Secondary carboxylic acid amides Amino acids and derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Dialkylthioethers Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolyl carboxylic acid derivative - Phthalimide - Isoindolone - Benzamide - Benzoic acid or derivatives - Indole - Isoindoline - Isoindole - Isoindole or derivatives - Benzoyl - Monocyclic benzene moiety - Benzenoid - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Thiolane - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Thioether - Azacycle - Dialkylthioether - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolyl carboxylic acids and derivatives. These are compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an indole ring.
External Descriptors
Not available