Compound Identification
SMILES
OC[C@@H](NC(=O)C1=CC(=CN1)C1=NC(NC2=CC=CC=C2)=NC=N1)C1=CC(Cl)=CC=C1
InChIKey
InChIKey=WWLROORXXZLBNG-LJQANCHMSA-N
Formula
C22H19ClN6O2
Mass
434.88
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Carboxylic acid derivatives
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Level 5
Carboxylic acid amides
- Level 6 2-heteroaryl carboxamides
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Level 5
Carboxylic acid amides
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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
Aniline and substituted anilines Pyrrole carboxamides Aminotriazines Chlorobenzenes 1,3,5-triazines Substituted pyrroles Aryl chlorides Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Secondary amines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Aniline or substituted anilines - 2-heteroaryl carboxamide - Amino-1,3,5-triazine - Aminotriazine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,3,5-triazine - Substituted pyrrole - Triazine - Benzenoid - Pyrrole - Heteroaromatic compound - Amino acid or derivatives - Secondary carboxylic acid amide - Organoheterocyclic compound - Secondary amine - Azacycle - Organohalogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Amine - Primary alcohol - Alcohol - Organochloride - 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