Compound Identification
SMILES
CC1(C)CC(=O)C2=C([C@@H]1O)C(=C(S2)N1CCOCC1)C1=CC(=NC=C1)C1=C(F)C=CC(=C1)C(=O)N1CCCC1
InChIKey
InChIKey=OQQCBWZSUNDZRZ-MHZLTWQESA-N
Formula
C30H32FN3O4S
Mass
549.66
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
- Subclass Phenylpyridines
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Phenylpyridines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyridines
Alternative Parents
4-halobenzoic acids and derivatives 3,4,5-trisubstituted-2-aminothiophenes Benzamides N-acylpyrrolidines Aryl alkyl ketones Dialkylarylamines Benzoyl derivatives Fluorobenzenes Morpholines Aryl fluorides Tertiary carboxylic acid amides Heteroaromatic compounds Secondary alcohols Amino acids and derivatives Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyridine - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3,4,5-trisubstituted-2-aminothiophene - Benzoic acid or derivatives - Benzamide - N-acylpyrrolidine - Benzoyl - Dialkylarylamine - Aryl alkyl ketone - Aryl ketone - Fluorobenzene - Halobenzene - Morpholine - 2-aminothiophene - Oxazinane - Benzenoid - Aryl halide - Aryl fluoride - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Thiophene - Pyrrolidine - Heteroaromatic compound - Carboxamide group - Amino acid or derivatives - Secondary alcohol - Tertiary amine - Ketone - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organonitrogen compound - Organooxygen compound - Amine - Alcohol - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
External Descriptors
Not available