Compound Identification
SMILES
OCC1OC(C(O)C(O)C1O)N1C(=S)C(=CC=C1C1=CC=C(Cl)C=C1)C#N
InChIKey
InChIKey=OOIZQMMAUYMGCV-UHFFFAOYSA-N
Formula
C18H17ClN2O5S
Mass
408.85
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
- Subclass Phenylpyridines
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Class
Pyridines and derivatives
-
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
Hexoses Glycosylamines 3-pyridinecarbonitriles Chlorobenzenes Dihydropyridines Aryl chlorides Oxanes Thiolactams Heteroaromatic compounds Secondary alcohols Polyols Azacyclic compounds Oxacyclic compounds Nitriles Organosulfur compounds Organopnictogen compounds Organochlorides Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hexose monosaccharide - 2-phenylpyridine - Glycosyl compound - N-glycosyl compound - 3-pyridinecarbonitrile - Chlorobenzene - Dihydropyridine - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Hydropyridine - Monosaccharide - Oxane - Heteroaromatic compound - Thiolactam - Secondary alcohol - Oxacycle - Azacycle - Nitrile - Carbonitrile - Polyol - Organosulfur compound - Primary alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - Alcohol - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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