Compound Identification
SMILES
COC1=C(Br)C=C(C=C1)[C@H]1C(C#N)=C(N)OC2=C1C(=O)NC(=S)N2
InChIKey
InChIKey=RHOCHWYVBBGFMS-JTQLQIEISA-N
Formula
C15H11BrN4O3S
Mass
407.24
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyranopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyranopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyranopyrimidines
Alternative Parents
Pyranopyridines Anisoles Phenoxy compounds Methoxybenzenes 2-Thiopyrimidines Alkyl aryl ethers Pyrimidones Pyrimidinethiones Bromobenzenes Aryl bromides Pyridines and derivatives Heteroaromatic compounds Vinylogous amides Vinylogous esters Lactams Ketene acetals Thioureas Nitriles Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Amines Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyranopyridine - Pyranopyrimidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - 2-thiopyrimidine - Pyrimidinethione - Pyrimidone - Thiopyrimidine - Halobenzene - Bromobenzene - Benzenoid - Pyridine - Pyrimidine - Aryl bromide - Monocyclic benzene moiety - Aryl halide - Vinylogous amide - Vinylogous ester - Heteroaromatic compound - Ketene acetal or derivatives - Lactam - Thiourea - Oxacycle - Ether - Azacycle - Carbonitrile - Nitrile - Amine - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyranopyrimidines. These are polycyclic aromatic compounds containing a pyran ring fused to a pyrimidine ring.
External Descriptors
Not available