Compound Identification
SMILES
OC(=O)C1=CC=C(CN2C=NC3=C(N=C(S3)C(=O)NCC3=CC=CC=C3)C2=O)C=C1
InChIKey
InChIKey=WNKSKASHGXBJGB-UHFFFAOYSA-N
Formula
C21H16N4O4S
Mass
420.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
1,3-thiazolo[5,4-d]pyrimidines
Subclass
7-oxo-1,3-thiazolo[5,4-d]pyrimidines
Intermediate Tree Nodes
Not available
Direct Parent
7-oxo-1,3-thiazolo[5,4-d]pyrimidines
Alternative Parents
Benzoic acids Thiazolecarboxamides Benzoyl derivatives 2-heteroaryl carboxamides Pyrimidones Heteroaromatic compounds Secondary carboxylic acid amides Lactams Carboxylic acids Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-oxo-1,3-thiazolo[5,4-d]pyrimidine - Benzoic acid or derivatives - Benzoic acid - 2-heteroaryl carboxamide - Benzoyl - Thiazolecarboxylic acid or derivatives - Thiazolecarboxamide - Pyrimidone - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Azole - Heteroaromatic compound - Thiazole - Carboxamide group - Lactam - Secondary carboxylic acid amide - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 7-oxo-1,3-thiazolo[5,4-d]pyrimidines. These are aromatic heteropolycyclic compounds containing a 1,3-thiazolo[5,4-d]pyrimidine ring system that carries an oxo group at the 7-position. 1,3-thiazolo[5,4-d]pyrimidine consists of a 1,3-thiazole ring fused to but not sharing a nitrogen atom with a pyrimidine ring.
External Descriptors
Not available