Compound Identification
SMILES
CCN(CC)CCNC(=O)C1=CC(C)=C(N1)\C=C1/C(=O)NC2=C1C(NC1=C(F)C=C(Cl)C=C1)=NC=N2
InChIKey
InChIKey=VYCCLXYWLSXHKT-VBKFSLOCSA-N
Formula
C25H27ClFN7O2
Mass
511.99
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolopyrimidines
Alternative Parents
2-heteroaryl carboxamides Pyrrole carboxamides Aniline and substituted anilines Aminopyrimidines and derivatives Chlorobenzenes Fluorobenzenes Substituted pyrroles Aryl chlorides Aryl fluorides Imidolactams Heteroaromatic compounds Lactams Secondary carboxylic acid amides Amino acids and derivatives Trialkylamines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyrimidine - 2-heteroaryl carboxamide - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Aniline or substituted anilines - Aminopyrimidine - Halobenzene - Fluorobenzene - Chlorobenzene - Pyrimidine - Aryl chloride - Benzenoid - Imidolactam - Monocyclic benzene moiety - Substituted pyrrole - Aryl halide - Aryl fluoride - Pyrrole - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Lactam - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolopyrimidines. These are compounds containing a pyrrolopyrimidine moiety, which consists of a pyrrole ring fused to a pyrimidine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available