Compound Identification
SMILES
COC1=CC=C(NC(=O)CSC2=NC(N)=C3C4=C(CC(C)CC4)SC3=N2)C=C1
InChIKey
InChIKey=WISWEMQZTHZBKI-UHFFFAOYSA-N
Formula
C20H22N4O2S2
Mass
414.54
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
Anilides Methoxyanilines Anisoles Methoxybenzenes N-arylamides Phenoxy compounds Alkylarylthioethers Alkyl aryl ethers Aminopyrimidines and derivatives Imidolactams Heteroaromatic compounds Thiophenes Amino acids and derivatives Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Anilide - Methoxyaniline - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Phenol ether - N-arylamide - Aminopyrimidine - Alkylarylthioether - Alkyl aryl ether - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrimidine - Heteroaromatic compound - Thiophene - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Thioether - Primary amine - Amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - 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