Compound Identification
SMILES
CNC(=O)C1CCN(CC2=CC3=C(S2)C(=NC(Cl)=N3)N2CCOCC2)CC1
InChIKey
InChIKey=MXYVDMOATFRPMH-UHFFFAOYSA-N
Formula
C18H24ClN5O2S
Mass
409.93
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
Piperidinecarboxamides 2,3,5-trisubstituted thiophenes Dialkylarylamines 2-halopyrimidines Aminopyrimidines and derivatives Aralkylamines Aryl chlorides Morpholines Imidolactams Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Trialkylamines Dialkyl ethers Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Piperidinecarboxamide - Thienopyrimidine - 2,3,5-trisubstituted thiophene - Dialkylarylamine - Aminopyrimidine - Halopyrimidine - 2-halopyrimidine - Aralkylamine - Aryl chloride - Aryl halide - Morpholine - Oxazinane - Piperidine - Pyrimidine - Imidolactam - Heteroaromatic compound - Thiophene - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Azacycle - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Amine - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - 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