Compound Identification
SMILES
CC1(C)NC(=O)C2=C(C1O)C(=C(S2)N1CCOCC1)C1=CC(=NC=C1)C1=C(F)C=CC(=C1)C(=O)N1CCCC1
InChIKey
InChIKey=BHHMDCLDGZMLHZ-UHFFFAOYSA-N
Formula
C29H31FN4O4S
Mass
550.65
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 Thienopyridines Benzamides 3,4,5-trisubstituted-2-aminothiophenes Benzoyl derivatives Dialkylarylamines 2-heteroaryl carboxamides N-acylpyrrolidines Fluorobenzenes Aryl fluorides Morpholines Heteroaromatic compounds Tertiary carboxylic acid amides Lactams Amino acids and derivatives Secondary alcohols Secondary carboxylic acid amides 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 - Benzamide - Benzoic acid or derivatives - 3,4,5-trisubstituted-2-aminothiophene - Thienopyridine - 2-heteroaryl carboxamide - Benzoyl - N-acylpyrrolidine - Dialkylarylamine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Morpholine - Oxazinane - 2-aminothiophene - Benzenoid - Pyrrolidine - Thiophene - Tertiary carboxylic acid amide - Heteroaromatic compound - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Amino acid or derivatives - Carboxamide group - Lactam - Azacycle - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Amine - Alcohol - Organooxygen compound - Hydrocarbon derivative - 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