Compound Identification
SMILES
CC1=C(C(=O)C(C#N)=C2SC(=CC3=CC=NC=C3)C(=O)N2C2=C(C)C=CC=C2C)C2=CC=CC=C2N1
InChIKey
InChIKey=UBHXRJJQNSIFIN-UHFFFAOYSA-N
Formula
C29H22N4O2S
Mass
490.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass Indoles
-
Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
Indoles
Alternative Parents
m-Xylenes Aryl ketones Substituted pyrroles Pyridines and derivatives Vinylogous amides Thiazoles Heteroaromatic compounds Enones Acryloyl compounds Lactams Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole - M-xylene - Xylene - Aryl ketone - Monocyclic benzene moiety - Pyridine - Benzenoid - Substituted pyrrole - Acryloyl-group - Azole - Enone - Heteroaromatic compound - Vinylogous amide - Thiazole - Pyrrole - Ketone - Lactam - Nitrile - Carbonitrile - Azacycle - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
External Descriptors
Not available