Compound Identification
SMILES
N[C@H]1CCCC[C@H]1NC1=NC=C(C(N)=O)C(NC2=CC(OC3CCOCC3)=CC=C2)=N1
InChIKey
InChIKey=ATVFQVJVOCRRIY-RBUKOAKNSA-N
Formula
C22H30N6O3
Mass
426.521
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
-
Level 5
Pyrimidinecarboxylic acids and derivatives
- Level 6 Pyrimidinecarboxamides
-
Level 5
Pyrimidinecarboxylic acids and derivatives
-
Subclass
Pyrimidines and pyrimidine derivatives
-
Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Pyrimidinecarboxylic acids and derivatives
Direct Parent
Pyrimidinecarboxamides
Alternative Parents
Phenoxy compounds Phenol ethers Aniline and substituted anilines Alkyl aryl ethers Secondary alkylarylamines Aminopyrimidines and derivatives Cyclohexylamines Oxanes Imidolactams Heteroaromatic compounds Vinylogous amides Amino acids and derivatives Primary carboxylic acid amides Dialkyl ethers Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Monoalkylamines Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidinecarboxamide - Phenol ether - Phenoxy compound - Aniline or substituted anilines - Alkyl aryl ether - Aminopyrimidine - Cyclohexylamine - Secondary aliphatic/aromatic amine - Imidolactam - Benzenoid - Monocyclic benzene moiety - Oxane - Heteroaromatic compound - Vinylogous amide - Primary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Secondary amine - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Hydrocarbon derivative - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Primary amine - Organic oxygen compound - Amine - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidinecarboxamides. These are compounds containing a pyrimidine ring which bears a carboxamide.
External Descriptors
Not available