Compound Identification
SMILES
[O-][N+](=O)C1=CC2=C(OCO2)C=C1C=NNC1=NC(=NC(NCC2=CC=CC=C2)=N1)N1CCOCC1
InChIKey
InChIKey=QFFKEVLOMVAJLE-UHFFFAOYSA-N
Formula
C22H22N8O5
Mass
478.469
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
Benzodioxoles 1,3,5-triazine-2,4-diamines Nitroaromatic compounds Dialkylarylamines Benzylamines Secondary alkylarylamines 1,3,5-triazines Morpholines Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Acetals Organic oxoazanium compounds Azacyclic compounds Hydrazones Dialkyl ethers Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-benzylamino-s-triazine - Benzodioxole - 2,4-diamine-s-triazine - Nitroaromatic compound - Benzylamine - Dialkylarylamine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Morpholine - Oxazinane - 1,3,5-triazine - Benzenoid - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Acetal - Dialkyl ether - Ether - Hydrazone - Organic oxoazanium - Oxacycle - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic zwitterion - Organic salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic 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