Compound Identification
SMILES
C[C@H]([NH+]1CCN(CC2=CC=CC=C2C)CC1)C1=NC2=C(C(C)=C(C)S2)C(=O)N1
InChIKey
InChIKey=DTZHOTPTLDPAKR-INIZCTEOSA-O
Formula
C22H29N4OS
Mass
397.56
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
Phenylmethylamines Benzylamines Toluenes Pyrimidones Aralkylamines N-alkylpiperazines Thiophenes Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Lactams Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Benzylamine - Phenylmethylamine - Pyrimidone - Toluene - N-alkylpiperazine - Aralkylamine - Benzenoid - 1,4-diazinane - Monocyclic benzene moiety - Piperazine - Pyrimidine - Heteroaromatic compound - Quaternary ammonium salt - Thiophene - Tertiary aliphatic amine - Lactam - Tertiary amine - Azacycle - Hydrocarbon derivative - Amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organic cation - 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