Compound Identification
SMILES
COC1=CC(NC2=NC=C(F)C(=N2)N(C(Cl)=S)C2=NC3=C(OC(C)(C)C(=O)N3)C=C2)=CC(OC)=C1OC
InChIKey
InChIKey=YZYHPTQXLAZEID-UHFFFAOYSA-N
Formula
C23H22ClFN6O5S
Mass
548.97
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
Methoxyanilines Anisoles Methoxybenzenes Phenoxy compounds Aminopyrimidines and derivatives Alkyl aryl ethers Halopyrimidines Pyridines and derivatives Aryl fluorides Imidolactams Heteroaromatic compounds Tertiary amines Secondary carboxylic acid amides Amino acids and derivatives Thiocarbamic acid halides Lactams Oxacyclic compounds Secondary amines Azacyclic compounds Organic oxides Organochlorides Organofluorides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridopyrimidine - Methoxyaniline - Anisole - Phenol ether - Aniline or substituted anilines - Phenoxy compound - Methoxybenzene - Halopyrimidine - Alkyl aryl ether - Aminopyrimidine - Monocyclic benzene moiety - Pyridine - Aryl halide - Pyrimidine - Aryl fluoride - Benzenoid - Imidolactam - Heteroaromatic compound - Secondary carboxylic acid amide - Tertiary amine - Thiocarbamic acid halide - Carboxamide group - Lactam - Amino acid or derivatives - Azacycle - Oxacycle - Secondary amine - Carboxylic acid derivative - Ether - Organic oxide - Organic oxygen compound - Organosulfur compound - Carbonyl group - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - Organofluoride - 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