Compound Identification
SMILES
COC1=CC=C(C=C1)C1=C2C3=C(CNCC3)SC2=NC(CN2C(=O)CCC2=O)=C1Cl
InChIKey
InChIKey=KDCOJKHGISLURG-UHFFFAOYSA-N
Formula
C22H20ClN3O3S
Mass
441.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Thienopyridines Anisoles Methoxybenzenes Phenoxy compounds Aralkylamines Alkyl aryl ethers N-substituted carboxylic acid imides N-alkylpyrrolidines Pyrrolidine-2-ones Aryl chlorides Thiophenes Heteroaromatic compounds Dicarboximides Lactams Amino acids and derivatives Dialkylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylpyridine - Thienopyridine - Phenoxy compound - Phenol ether - Anisole - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Carboxylic acid imide, n-substituted - Aryl chloride - Pyrrolidone - 2-pyrrolidone - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Aryl halide - Carboxylic acid imide - Heteroaromatic compound - Thiophene - Pyrrolidine - Dicarboximide - Amino acid or derivatives - Lactam - Azacycle - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Organooxygen compound - Organic oxygen compound - Carbonyl group - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - 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