Compound Identification
SMILES
COC1=CC(NC2=NC=C3SC=C(C3=N2)C2=CC(CO)=CC=C2)=CC(OC)=C1OC
InChIKey
InChIKey=YSRJTUUULANOPJ-UHFFFAOYSA-N
Formula
C22H21N3O4S
Mass
423.49
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
Methoxyanilines Phenoxy compounds Methoxybenzenes Benzyl alcohols Anisoles Aminopyrimidines and derivatives Alkyl aryl ethers Thiophenes Heteroaromatic compounds Secondary amines Azacyclic compounds Primary alcohols Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Methoxyaniline - Anisole - Benzyl alcohol - Phenol ether - Aniline or substituted anilines - Phenoxy compound - Methoxybenzene - Aminopyrimidine - Alkyl aryl ether - Benzenoid - Pyrimidine - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Azacycle - Secondary amine - Ether - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - Primary alcohol - Alcohol - Organic nitrogen compound - Aromatic alcohol - Hydrocarbon derivative - 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