Compound Identification
SMILES
CC1=C(SC2=C1C(=O)N(CC1=CC(F)=CC=C1)C=N2)C(=O)NCCCN1CCOCC1
InChIKey
InChIKey=CQWZRNWHPIGFNE-UHFFFAOYSA-N
Formula
C22H25FN4O3S
Mass
444.53
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
Pyrimidinecarboxamides 2-heteroaryl carboxamides Thiophene carboxamides Fluorobenzenes Pyrimidones Aryl fluorides Morpholines Heteroaromatic compounds Amino acids and derivatives Lactams Secondary carboxylic acid amides Trialkylamines Dialkyl ethers Azacyclic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidinecarboxamide - Thienopyrimidine - 2-heteroaryl carboxamide - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Pyrimidone - Fluorobenzene - Halobenzene - Benzenoid - Oxazinane - Pyrimidine - Monocyclic benzene moiety - Aryl halide - Morpholine - Aryl fluoride - Thiophene - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Lactam - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Oxacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Organohalogen compound - Hydrocarbon derivative - Amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - 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