Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(=O)C2=C(SC3=C2CC(C)(C)OC3)N=C1N\N=C\C1=CC=C(Cl)C=C1
InChIKey
InChIKey=GFJJEVLTWNTKFU-UVHMKAGCSA-N
Formula
C25H23ClN4O3S
Mass
494.99
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 Thienopyrans Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Pyrimidones Aryl chlorides Pyrans Thiophenes Heteroaromatic compounds Lactams Oxacyclic compounds Hydrazones Dialkyl ethers Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyran - Methoxyaniline - Thienopyrimidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyran - Pyrimidine - Benzenoid - Heteroaromatic compound - Thiophene - Lactam - Azacycle - Oxacycle - Dialkyl ether - Hydrazone - Ether - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organochloride - Organonitrogen 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