Compound Identification
SMILES
NC(CC1=CNC2=CC=CC=C12)C(O)=O.CCOP(=S)(OCC)SCSC1=C(Cl)C=CC(Cl)=C1
InChIKey
InChIKey=WWCUXEWSWWECJQ-UHFFFAOYSA-N
Formula
C22H27Cl2N2O4PS3
Mass
581.52
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
3-alkylindoles Alpha amino acids Thiophenol ethers Dichlorobenzenes Alkylarylthioethers Aralkylamines Substituted pyrroles Aryl chlorides Dithiophosphate O-esters Dithiophosphate S-esters Heteroaromatic compounds Amino acids Organothiophosphorus compounds Carboxylic acids Azacyclic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organochlorides Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Not available
Substituents
Indolyl carboxylic acid derivative - Alpha-amino acid - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Aryl thioether - 1,4-dichlorobenzene - Thiophenol ether - Chlorobenzene - Halobenzene - Aralkylamine - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Dithiophosphate o-ester - Substituted pyrrole - Dithiophosphate s-ester - Benzenoid - Pyrrole - Organic dithiophosphate - Heteroaromatic compound - Amino acid or derivatives - Amino acid - Organothiophosphorus compound - Sulfenyl compound - Azacycle - Thioether - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Hydrocarbon derivative - Primary aliphatic amine - Organic oxide - Organohalogen compound - Organochloride - Carbonyl group - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Organic nitrogen 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