Compound Identification
SMILES
NC1=NC(=NO1)C1=C2NC=C(C(=O)C(=O)N3CCN(CC3)C(=O)C3=CC=CC=N3)C2=C(F)C=C1
InChIKey
InChIKey=XKPSRJBNCRODMN-UHFFFAOYSA-N
Formula
C22H18FN7O4
Mass
463.429
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
- Subclass Indoles
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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
Pyridinecarboxylic acids and derivatives 2-heteroaryl carboxamides Aryl ketones Aryl fluorides Benzenoids Piperazines Substituted pyrroles Heteroaromatic compounds Vinylogous amides Tertiary carboxylic acid amides 1,2,4-oxadiazoles Amino acids and derivatives Azacyclic compounds Oxacyclic compounds Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Aryl ketone - Aryl fluoride - Aryl halide - 1,4-diazinane - Piperazine - Pyridine - Substituted pyrrole - Benzenoid - 1,2,4-oxadiazole - Azole - Oxadiazole - Heteroaromatic compound - Pyrrole - Tertiary carboxylic acid amide - Vinylogous amide - Carboxamide group - Amino acid or derivatives - Ketone - Azacycle - Oxacycle - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Organopnictogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Primary amine - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen 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