Compound Identification
SMILES
CCN(CC)CCNC(=O)C1=C(C)NC(\C=C2/C(=O)NC3=C2C(NC2=CC(Cl)=C(F)C=C2)=NC=N3)=C1C
InChIKey
InChIKey=DYAPCMBXNXESMW-ATVHPVEESA-N
Formula
C26H29ClFN7O2
Mass
526.01
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
Pyrrole carboxamides Aniline and substituted anilines Aminopyrimidines and derivatives Fluorobenzenes Chlorobenzenes Substituted pyrroles Imidolactams Aryl chlorides Aryl fluorides Vinylogous amides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Lactams Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyrimidine - Pyrrole-3-carboxamide - Pyrrole-3-carboxylic acid or derivatives - Aniline or substituted anilines - Aminopyrimidine - Halobenzene - Fluorobenzene - Chlorobenzene - Pyrimidine - Aryl chloride - Aryl fluoride - Imidolactam - Benzenoid - Monocyclic benzene moiety - Substituted pyrrole - Aryl halide - Vinylogous amide - 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