Compound Identification
SMILES
CSC1=C(C=CC(CN2CCCN(CC3=NOC(=N3)C3=C(C)ON=C3C)CC2)=N1)C#N
InChIKey
InChIKey=BBEABYLMBZNILG-UHFFFAOYSA-N
Formula
C21H25N7O2S
Mass
439.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
- Subclass 2-pyridylmethylamines
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
2-pyridylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
6-substituted-2-pyridinylmethylamines
Alternative Parents
3-pyridinecarbonitriles Aralkylamines Alkylarylthioethers 1,4-diazepanes Isoxazoles Heteroaromatic compounds 1,2,4-oxadiazoles Trialkylamines Sulfenyl compounds Oxacyclic compounds Nitriles Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
6-substituted-2-pyridinylmethylamine - Aryl thioether - 3-pyridinecarbonitrile - 1,4-diazepane - Diazepane - Aralkylamine - Alkylarylthioether - 1,2,4-oxadiazole - Azole - Heteroaromatic compound - Isoxazole - Oxadiazole - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Carbonitrile - Nitrile - Azacycle - Sulfenyl compound - Thioether - Amine - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Cyanide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 6-substituted-2-pyridinylmethylamines. These are aromatic heterocyclic compounds contaning a pyridine ring which is substituted at the 2-position with a methylamine, and at the 6-position with any non-hydrogen atom.
External Descriptors
Not available