Compound Identification
SMILES
COC(=O)C1=C2C(CC3=CC(CC(SC)C(N1C)=C2C(=O)OC)=CC=C3)SC
InChIKey
InChIKey=ZZWZMGIVMKTFLO-UHFFFAOYSA-N
Formula
C21H25NO4S2
Mass
419.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrroles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Pyrrole carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrole carboxylic acids and derivatives
Alternative Parents
N-methylpyrroles Benzenoids Vinylogous amides Methyl esters Heteroaromatic compounds Sulfenyl compounds Dialkylthioethers Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrole-3-carboxylic acid or derivatives - Pyrrole-2-carboxylic acid or derivatives - N-methylpyrrole - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Vinylogous amide - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Thioether - Sulfenyl compound - Dialkylthioether - Organic oxide - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrole carboxylic acids and derivatives. These are heterocyclic compounds containing a pyrrole ring bearing a carboxyl group (or a derivative thereof).
External Descriptors
Not available