Compound Identification
SMILES
CC1C(CSC2=CC=CC=[N+]2[O-])OC(OC1C1=CC=C(CO)C=C1)C1=CC=C(CNC(=O)C2=CN=CC=C2)C=C1
InChIKey
InChIKey=HTIPSSCSSZKSCL-UHFFFAOYSA-N
Formula
C31H31N3O5S
Mass
557.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
-
Subclass
Pyridinecarboxylic acids and derivatives
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Level 5
Pyridinecarboxamides
- Level 6 Nicotinamides
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Level 5
Pyridinecarboxamides
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Subclass
Pyridinecarboxylic acids and derivatives
-
Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes
Pyridinecarboxamides
Direct Parent
Nicotinamides
Alternative Parents
Benzyl alcohols Alkylarylthioethers 1,3-dioxanes Pyridinium derivatives Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Acetals Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Aromatic alcohols Primary alcohols Organic oxides Organic salts Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nicotinamide - Aryl thioether - Benzyl alcohol - Alkylarylthioether - Meta-dioxane - Monocyclic benzene moiety - Pyridinium - Benzenoid - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Thioether - Sulfenyl compound - Alcohol - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Aromatic alcohol - Organopnictogen compound - Organic salt - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nicotinamides. These are heterocyclic aromatic compounds containing a pyridine ring substituted at position 3 by a carboxamide group.
External Descriptors
Not available