Compound Identification
SMILES
CC1=NC(C(=O)N2CCNC[C@H]2CNC(=O)N2CCC3=C2C=C(F)C=C3)=C(S1)C1=CC=C(F)C=C1
InChIKey
InChIKey=JBPOUBSAYUHBIL-FQEVSTJZSA-N
Formula
C25H25F2N5O2S
Mass
497.56
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
Indolecarboxylic acids and derivatives
Alternative Parents
2,4,5-trisubstituted thiazoles Thiazolecarboxamides 2-heteroaryl carboxamides Fluorobenzenes Piperazines Aryl fluorides Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids and derivatives Ureas Dialkylamines Azacyclic compounds Organic oxides Carbonyl compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid derivative - 2-heteroaryl carboxamide - 2,4,5-trisubstituted 1,3-thiazole - Thiazolecarboxylic acid or derivatives - Thiazolecarboxamide - Fluorobenzene - Halobenzene - 1,4-diazinane - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Piperazine - Heteroaromatic compound - Thiazole - Azole - Tertiary carboxylic acid amide - Carboxamide group - Urea - Amino acid or derivatives - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Secondary amine - Organic nitrogen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole.
External Descriptors
Not available