Compound Identification
SMILES
O=C(N1CCC2=C(C1)C(=NC(=N2)C1=CC=CC=N1)N1CCOCC1)C1=CC=CS1
InChIKey
InChIKey=JCWOZUDXTWXDSQ-UHFFFAOYSA-N
Formula
C21H21N5O2S
Mass
407.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyridinylpyrimidines
-
Subclass
Pyrimidines and pyrimidine derivatives
-
Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinylpyrimidines
Alternative Parents
Pyridopyrimidines Thiophene carboxamides Dialkylarylamines 2-heteroaryl carboxamides Aminopyrimidines and derivatives Pyridines and derivatives Morpholines Imidolactams Tertiary carboxylic acid amides Heteroaromatic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridinylpyrimidine - Pyridopyrimidine - 2-heteroaryl carboxamide - Thiophene carboxamide - Dialkylarylamine - Thiophene carboxylic acid or derivatives - Aminopyrimidine - Morpholine - Oxazinane - Pyridine - Imidolactam - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiophene - Carboxamide group - Oxacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Azacycle - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpyrimidines. These are compounds containing a pyridinylpyrimidine skeleton, which consists of a pyridine linked (not fused) to a pyrimidine by a bond.
External Descriptors
Not available