Compound Identification
SMILES
CC1=C/C(/S\C\1=C/N=O)=C1/NC(NC2=CC=C(OCCN3CCCC3)C=C2)=NC2=C1C=CN2
InChIKey
InChIKey=BQNPZCYCIORTBK-FAEUNECHSA-N
Formula
C24H26N6O2S
Mass
462.57
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
Phenoxy compounds Phenol ethers Aniline and substituted anilines Alkyl aryl ethers N-alkylpyrrolidines Thiophenes Pyrroles Heteroaromatic compounds Trialkylamines Guanidines Propargyl-type 1,3-dipolar organic compounds C-nitroso compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyrimidine - Phenoxy compound - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Pyrrole - Heteroaromatic compound - Pyrrolidine - Thiophene - Guanidine - Tertiary amine - Tertiary aliphatic amine - Organic nitroso compound - C-nitroso compound - Ether - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Amine - 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