Compound Identification
SMILES
CCOC1=CC=CC=C1N1C(=S)NC(=O)C2=C1N=C(C=C2C(F)(F)F)C1CC1
InChIKey
InChIKey=RUNXBNOKYHVUEA-UHFFFAOYSA-N
Formula
C19H16F3N3O2S
Mass
407.41
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridopyrimidines
- Subclass Pyrido[2,3-d]pyrimidines
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Class
Pyridopyrimidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridopyrimidines
Subclass
Pyrido[2,3-d]pyrimidines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrido[2,3-d]pyrimidines
Alternative Parents
Phenoxy compounds Phenol ethers 2-Thiopyrimidines Alkyl aryl ethers Pyrimidones Pyrimidinethiones Pyridines and derivatives Vinylogous amides Heteroaromatic compounds Lactams Thioureas Azacyclic compounds Organic oxides Hydrocarbon derivatives Alkyl fluorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrido[2,3-d]pyrimidine - Phenol ether - Phenoxy compound - Alkyl aryl ether - Pyrimidinethione - Pyrimidone - Thiopyrimidine - 2-thiopyrimidine - Benzenoid - Pyridine - Pyrimidine - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous amide - Thiourea - Lactam - Azacycle - Ether - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrido[2,3-d]pyrimidines. These are compounds containing the pyrido[2,3-d]pyrimidine ring system, which is a pyridopyrimidine isomer with three ring nitrogen atoms at the 1-, 3-, and 8- position.
External Descriptors
Not available