Compound Identification
SMILES
CC1=CC=CC=C1N1C(CN2CCOCC2)=NC2=C(C3=C(CCCC3)S2)C1=O
InChIKey
InChIKey=INOCBTDYZXTQOZ-UHFFFAOYSA-N
Formula
C22H25N3O2S
Mass
395.52
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
Toluenes Pyrimidones Aralkylamines Morpholines Thiophenes Heteroaromatic compounds Trialkylamines Lactams Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Pyrimidone - Toluene - Aralkylamine - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyrimidine - Benzenoid - Heteroaromatic compound - Thiophene - Tertiary aliphatic amine - Lactam - Tertiary amine - Oxacycle - Azacycle - Ether - Dialkyl ether - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organooxygen compound - Amine - Hydrocarbon derivative - Organic nitrogen 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