Compound Identification
SMILES
COC1=CC=CC(C2=CC3=C(S2)C(=NC=N3)N(CC2=COCO2)CC2=CC=CC=C2)=C1F
InChIKey
InChIKey=JPSMTBKIISEBFH-UHFFFAOYSA-N
Formula
C24H20FN3O3S
Mass
449.5
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
Phenoxy compounds 2,3,5-trisubstituted thiophenes Anisoles Benzylamines Methoxybenzenes Dialkylarylamines Alkyl aryl ethers Aminopyrimidines and derivatives Fluorobenzenes Imidolactams Aryl fluorides 1,3-dioxoles Heteroaromatic compounds Azacyclic compounds Oxacyclic compounds Acetals Organofluorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Anisole - Benzylamine - Phenol ether - 2,3,5-trisubstituted thiophene - Dialkylarylamine - Methoxybenzene - Phenoxy compound - Fluorobenzene - Halobenzene - Alkyl aryl ether - Aminopyrimidine - Pyrimidine - Aryl halide - Monocyclic benzene moiety - Benzenoid - Imidolactam - Aryl fluoride - Thiophene - Heteroaromatic compound - Meta-dioxole - Ether - Acetal - Oxacycle - Azacycle - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen 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