Compound Identification
SMILES
CCNC1=NN=C(SCC2=NC(NCC3=CC(NC(=O)OCC=C)=CC=C3)=CC(=C2)N2CCOCC2)S1
InChIKey
InChIKey=FGVZTUIXLCIPSO-UHFFFAOYSA-N
Formula
C25H31N7O3S2
Mass
541.69
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzylamines
- Level 5 2-benzylaminopyridines
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Subclass
Benzylamines
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzylamines
Intermediate Tree Nodes
Not available
Direct Parent
2-benzylaminopyridines
Alternative Parents
Phenylcarbamic acid esters Dialkylarylamines 2-amino-5-substituted-1,3,4-thiadiazoles Alkylarylthioethers Aminopyridines and derivatives Morpholines Imidolactams Carbamate esters Heteroaromatic compounds Dialkyl ethers Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-benzylaminopyridine - Phenylcarbamic acid ester - Aryl thioether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aminopyridine - Alkylarylthioether - 2-amino-5-substituted-1,3,4-thiadiazole - 2-amino-1,3,4-thiadiazole - Imidolactam - Morpholine - Pyridine - Oxazinane - Azole - Heteroaromatic compound - Thiadiazole - Carbamic acid ester - Tertiary amine - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Carbonyl group - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-benzylaminopyridines. These are aromatic compounds containing pyridine ring substituted at the 2-position by a benzylamine group.
External Descriptors
Not available