Compound Identification
SMILES
CCC1=NC2=CC=CC=C2N1C1=NC2=C(SC(CN3CCN(CC3(C)C)C3COC3)=C2)C(=N1)N1CCOCC1
InChIKey
InChIKey=SHTICQDOCLQFOS-UHFFFAOYSA-N
Formula
C29H37N7O2S
Mass
547.72
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
Benzimidazoles 2,3,5-trisubstituted thiophenes Dialkylarylamines Aminopyrimidines and derivatives Aralkylamines N-alkylpiperazines Benzenoids N-substituted imidazoles Morpholines Imidolactams Heteroaromatic compounds Oxetanes Trialkylamines Dialkyl ethers Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Thienopyrimidine - 2,3,5-trisubstituted thiophene - Dialkylarylamine - Aminopyrimidine - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Morpholine - N-substituted imidazole - Oxazinane - Piperazine - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Thiophene - Imidazole - Azole - Tertiary aliphatic amine - Oxetane - Tertiary amine - Oxacycle - Ether - Azacycle - Dialkyl ether - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen 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