Compound Identification
SMILES
COC1=CC=C(CNC2=NC(SCC3=CC=CC=C3)=NC(=N2)C2=CC(C=O)=CC=C2)C=C1
InChIKey
InChIKey=WBQYUGRCXPPJKL-UHFFFAOYSA-N
Formula
C25H22N4O2S
Mass
442.54
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Triazines
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Subclass
Aminotriazines
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Level 5
N-aliphatic s-triazines
- Level 6 2-benzylamino-s-triazines
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Level 5
N-aliphatic s-triazines
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Subclass
Aminotriazines
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Class
Triazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Triazines
Subclass
Aminotriazines
Intermediate Tree Nodes
N-aliphatic s-triazines
Direct Parent
2-benzylamino-s-triazines
Alternative Parents
Phenoxy compounds Methoxybenzenes Benzylamines Benzoyl derivatives Benzaldehydes Anisoles Alkyl-2-thio-S-triazines Alkylarylthioethers Alkyl aryl ethers Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-benzylamino-s-triazine - Anisole - Phenoxy compound - Alkyl-2-thio-s-triazine - Aryl thioether - Benzaldehyde - Benzoyl - Benzylamine - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aryl-aldehyde - Alkylarylthioether - Benzenoid - 1,3,5-triazine - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Sulfenyl compound - Ether - Thioether - Amine - Hydrocarbon derivative - Organic oxide - Aldehyde - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-benzylamino-s-triazines. These are aromatic heterocyclic compounds containing a S-triazine ring, which is N-substituted at the 2-position with a benzylamine.
External Descriptors
Not available