Compound Identification
SMILES
CC1=C(N=NC2=CC=C(Cl)C=C2)C(C)=C(C#N)C(=S)N1C1OC(CO)C(O)C(O)C1O
InChIKey
InChIKey=YPPXRESMIKWDBD-UHFFFAOYSA-N
Formula
C20H21ClN4O5S
Mass
464.92
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Glycosyl compounds
- Level 6 Glycosylamines
-
Level 5
Glycosyl compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Glycosyl compounds
Direct Parent
Glycosylamines
Alternative Parents
Hexoses 3-pyridinecarbonitriles Chlorobenzenes Dihydropyridines Methylpyridines Aryl chlorides Oxanes Thiolactams Heteroaromatic compounds Secondary alcohols Azo compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Polyols Oxacyclic compounds Nitriles Organosulfur compounds Organochlorides Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hexose monosaccharide - N-glycosyl compound - 3-pyridinecarbonitrile - Halobenzene - Methylpyridine - Dihydropyridine - Chlorobenzene - Monosaccharide - Oxane - Hydropyridine - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Benzenoid - Pyridine - Thiolactam - Heteroaromatic compound - Azo compound - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Polyol - Carbonitrile - Nitrile - Hydrocarbon derivative - Cyanide - Primary alcohol - Alcohol - Organosulfur compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as glycosylamines. These are compounds consisting of an amine with a beta-N-glycosidic bond to a carbohydrate, thus forming a cyclic hemiaminal ether bond (alpha-amino ether).
External Descriptors
Not available