Compound Identification
SMILES
CCOC(=O)C1=C(C)N=C(NC2=NC3=C(CCN3CC3=CN=CC=C3)C(NCCCN3CCCCC3C)=N2)S1
InChIKey
InChIKey=DLRANQHGYJNHQF-UHFFFAOYSA-N
Formula
C28H38N8O2S
Mass
550.73
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
Thiazolecarboxylic acids and derivatives 2,4,5-trisubstituted thiazoles Dialkylarylamines Aminopyrimidines and derivatives Pyridines and derivatives Piperidines 2-amino-1,3-thiazoles Imidolactams Pyrroles Heteroaromatic compounds Trialkylamines Amino acids and derivatives Carboxylic acid esters Azacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyrimidine - 2,4,5-trisubstituted 1,3-thiazole - Thiazolecarboxylic acid or derivatives - Dialkylarylamine - Aminopyrimidine - Piperidine - Pyridine - Pyrimidine - Imidolactam - 1,3-thiazol-2-amine - Thiazole - Heteroaromatic compound - Azole - Pyrrole - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic oxygen compound - Organic oxide - 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