Compound Identification
SMILES
[Cl-].CC(OC(=O)C(C)(C)C)[N+]1=CC=CC(=C1)[C@H]1SCC2=C(C=CN12)C(=O)C1=CN(C(=O)N(C)C)C2=C1C=CC(=C2)C1=CC=C(F)C=C1
InChIKey
InChIKey=BTALARSOUSQACE-WCOQKMAPSA-M
Formula
C36H36ClFN4O4S
Mass
675.22
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
Indolecarboxamides and derivatives
Alternative Parents
Indoles Aryl ketones Pyrrole carboxamides Fluorobenzenes Aryl fluorides Substituted pyrroles Pyridinium derivatives Vinylogous amides Heteroaromatic compounds Ureas Carboxylic acid esters Monocarboxylic acids and derivatives Dialkylthioethers Azacyclic compounds Organic oxides Organic chloride salts Hydrocarbon derivatives Organofluorides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxamide derivative - Indole - Pyrrole-1-carboxamide - Pyrrole-1-carboxylic acid or derivatives - Aryl ketone - Fluorobenzene - Halobenzene - Monocyclic benzene moiety - Aryl halide - Benzenoid - Pyridine - Pyridinium - Aryl fluoride - Substituted pyrrole - Heteroaromatic compound - Vinylogous amide - Pyrrole - Carboxylic acid ester - Ketone - Urea - Thioether - Azacycle - Carboxylic acid derivative - Dialkylthioether - Monocarboxylic acid or derivatives - Organooxygen compound - Organic chloride salt - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organic salt - Organic oxide - Organonitrogen compound - Carbonyl group - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolecarboxamides and derivatives. These are compounds containing a carboxamide group attached to an indole.
External Descriptors
Not available