Compound Identification
SMILES
CCOC1=CC=C(C=C1)N1C(=O)C2=C(N=C1SCC(=O)NC1=C(C)C=CC(C)=C1)C1=CC=CC=C1N2
InChIKey
InChIKey=VGVXZELMNJTBIC-UHFFFAOYSA-N
Formula
C28H26N4O3S
Mass
498.6
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
Anilides Indoles p-Xylenes N-arylamides Phenol ethers Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Pyrimidones Heteroaromatic compounds Pyrroles Lactams Secondary carboxylic acid amides Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole - Indole or derivatives - Pyrrolopyrimidine - Anilide - Phenoxy compound - P-xylene - Xylene - Aryl thioether - Phenol ether - N-arylamide - Alkyl aryl ether - Pyrimidone - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Pyrimidine - Pyrrole - Heteroaromatic compound - Carboxamide group - Lactam - Secondary carboxylic acid amide - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Ether - Thioether - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur 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