Compound Identification
SMILES
OC(CNC1CCN(CC1)C1=C2C(SC=C2C2=CC=CC=C2)=NC=N1)COC1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=ILTHALYTZJDIEG-UHFFFAOYSA-N
Formula
C27H28N4O4S
Mass
504.61
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thienopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thienopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thienopyrimidines
Alternative Parents
Benzodioxoles Dialkylarylamines Alkyl aryl ethers Aminopiperidines Aminopyrimidines and derivatives Benzene and substituted derivatives Imidolactams Thiophenes Heteroaromatic compounds 1,2-aminoalcohols Secondary alcohols Acetals Dialkylamines Azacyclic compounds Oxacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Thienopyrimidine - Dialkylarylamine - Alkyl aryl ether - 4-aminopiperidine - Aminopyrimidine - Monocyclic benzene moiety - Piperidine - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Thiophene - Secondary alcohol - 1,2-aminoalcohol - Secondary amine - Azacycle - Acetal - Oxacycle - Ether - Secondary aliphatic amine - Alcohol - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thienopyrimidines. These are heterocyclic compounds containing a thiophene ring fused to a pyrimidine ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur 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