Compound Identification
SMILES
CSC1=CC(C(=O)OCC2=CC(=O)N3C=C(C)C=CC3=N2)=C(Cl)C=C1
InChIKey
InChIKey=HTQKXCJQBAMWPF-UHFFFAOYSA-N
Formula
C18H15ClN2O3S
Mass
374.84
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyridopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyridopyrimidines
Alternative Parents
2-halobenzoic acids and derivatives Benzoic acid esters M-sulfanylbenzoic acids and derivatives Thiophenol ethers Benzoyl derivatives Pyrimidones Alkylarylthioethers Methylpyridines Chlorobenzenes Aryl chlorides Vinylogous halides Heteroaromatic compounds Carboxylic acid esters Lactams Sulfenyl compounds Azacyclic compounds Organic oxides Organochlorides Organonitrogen compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - M-sulfanylbenzoic acid or derivatives - Pyridopyrimidine - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Aryl thioether - Benzoyl - Thiophenol ether - Chlorobenzene - Halobenzene - Methylpyridine - Pyrimidone - Alkylarylthioether - Benzenoid - Aryl chloride - Aryl halide - Pyridine - Pyrimidine - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous halide - Lactam - Carboxylic acid ester - Thioether - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Organosulfur compound - Organic nitrogen compound - Organohalogen compound - Organic oxide - Organochloride - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridopyrimidines. These are compounds containing a pyridopyrimidine, which consists of a pyridine fused to a pyrimidine. Pyridine is 6-membered ring consisting of five carbon atoms and a nitrogen 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