Compound Identification
SMILES
CC1=CC2=C(N=CN=C2N1)C1=C(F)C=C(NS(=O)(=O)C2=CC=C(F)C=C2)C=C1
InChIKey
InChIKey=XGLDDFSCJYBLBP-UHFFFAOYSA-N
Formula
C19H14F2N4O2S
Mass
400.4
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Phenylpyrimidines
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrimidines
Alternative Parents
Sulfanilides Benzenesulfonamides Pyrrolo[2,3-d]pyrimidines Benzenesulfonyl compounds Fluorobenzenes Substituted pyrroles Organosulfonamides Aryl fluorides Heteroaromatic compounds Aminosulfonyl compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylpyrimidine - Sulfanilide - Benzenesulfonamide - Pyrrolopyrimidine - Pyrrolo[2,3-d]pyrimidine - Benzenesulfonyl group - Fluorobenzene - Halobenzene - Benzenoid - Organosulfonic acid amide - Aryl halide - Substituted pyrrole - Aryl fluoride - Monocyclic benzene moiety - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrole - Azacycle - Organofluoride - Organohalogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrimidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrimidine ring through a CC or CN bond. 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