Compound Identification
SMILES
COC1=CC=C(CN2C(=N)C(=CC3=C2N=C2N(C=CC=C2C)C3=O)S(=O)(=O)C2=CC=C(F)C=C2)C=C1
InChIKey
InChIKey=PGSWZCHWHKMNCA-UHFFFAOYSA-N
Formula
C26H21FN4O4S
Mass
504.54
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
Benzenesulfonyl compounds Phenoxy compounds Anisoles Methoxybenzenes Pyrimidones Alkyl aryl ethers Methylpyridines Fluorobenzenes Aryl fluorides Imidolactams Vinylogous amides Sulfones Heteroaromatic compounds Lactams Azacyclic compounds Organonitrogen compounds Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrido[2,3-d]pyrimidine - Benzenesulfonyl group - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Fluorobenzene - Methylpyridine - Halobenzene - Pyrimidone - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyridine - Pyrimidine - Benzenoid - Imidolactam - Vinylogous amide - Heteroaromatic compound - Sulfonyl - Sulfone - Lactam - Ether - Azacycle - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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