Compound Identification
SMILES
COC1=CC=C(C=C1)C1=CC[N+](=N1)C1=NC=NC2=C1NC=C2C(=O)C(=O)N1CCN(CC1)C(=O)C1=CC=CC=C1
InChIKey
InChIKey=ZMWVEYUZZCJYBC-UHFFFAOYSA-O
Formula
C29H26N7O4
Mass
536.571
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
Benzamides Anisoles Aryl ketones Benzoyl derivatives Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Imidolactams Piperazines Pyrimidines and pyrimidine derivatives Substituted pyrroles Heteroaromatic compounds Vinylogous amides Tertiary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzamide - Benzoic acid or derivatives - Pyrrolopyrimidine - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Methoxybenzene - Aryl ketone - Alkyl aryl ether - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Pyrimidine - Substituted pyrrole - Benzenoid - Imidolactam - Heteroaromatic compound - Tertiary carboxylic acid amide - Vinylogous amide - Pyrrole - Ketone - Carboxamide group - Azacycle - Ether - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic cation - 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