Compound Identification
SMILES
COC(=O)C1=CC(=NN1CC1=NOC(=C1)C1=CC=C(Cl)S1)C(=O)NC1CCN(CC1)C(C)C
InChIKey
InChIKey=YCCAZWMOIWVKTG-UHFFFAOYSA-N
Formula
C22H26ClN5O4S
Mass
491.99
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Carboxylic acid derivatives
-
Level 5
Carboxylic acid amides
- Level 6 2-heteroaryl carboxamides
-
Level 5
Carboxylic acid amides
-
Subclass
Carboxylic acid derivatives
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Carboxylic acid derivatives
Intermediate Tree Nodes
Carboxylic acid amides
Direct Parent
2-heteroaryl carboxamides
Alternative Parents
Pyrazole-5-carboxamides 2,5-disubstituted thiophenes Aryl chlorides Piperidines Heteroaromatic compounds Isoxazoles Methyl esters Secondary carboxylic acid amides Amino acids and derivatives Trialkylamines Azacyclic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organochlorides Organooxygen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-heteroaryl carboxamide - Pyrazole-5-carboxylic acid or derivatives - Pyrazole-5-carboxamide - Pyrazole-3-carboxylic acid or derivatives - 2,5-disubstituted thiophene - Aryl chloride - Aryl halide - Piperidine - Azole - Pyrazole - Thiophene - Methyl ester - Heteroaromatic compound - Isoxazole - Tertiary aliphatic amine - Secondary carboxylic acid amide - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-heteroaryl carboxamides. These are compounds containing a heteroaromatic ring that carries a carboxamide group.
External Descriptors
Not available