Compound Identification
SMILES
CC1CCN(CC1)C(=O)CN1C2=C(C(C)=C(S2)C([O-])=O)C(=O)N(C1=O)C1=CC=CC=C1
InChIKey
InChIKey=SRZDXBGUGGWWAQ-UHFFFAOYSA-M
Formula
C22H22N3O5S
Mass
440.49
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
N-acylpiperidines Thiophene carboxylic acids Pyrimidones Benzene and substituted derivatives Vinylogous amides Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids Ureas Carboxylic acid salts Tertiary amines Lactams Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-piperidine - Thienopyrimidine - Thiophene carboxylic acid - Thiophene carboxylic acid or derivatives - Pyrimidone - Monocyclic benzene moiety - Piperidine - Pyrimidine - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Vinylogous amide - Thiophene - Amino acid or derivatives - Carboxamide group - Carboxylic acid salt - Lactam - Amino acid - Tertiary amine - Urea - Carboxylic acid - Azacycle - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Amine - Organic anion - 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