Compound Identification
SMILES
[Na+].[K+].[O-]S(=O)(=O)C1=CC(NC2=NC(NCC3=CC=C(NC4=NC(NC5=C6C(=CC(=C5)S([O-])(=O)=O)C=C(\C(=N\NC5=CC=CC=C5S([O-])(=O)=O)C6=O)S([O-])(=O)=O)=NC(Cl)=N4)C=C3)=NC(Cl)=N2)=C2C(=C1)C=C(\C(=N\NC1=CC=CC=C1S([O-])(=O)=O)C2=O)S([O-])(=O)=O
InChIKey
InChIKey=JHEOGAGXDNFURB-CVNJGSAWSA-H
Formula
C45H26Cl2KN14NaO20S6
Mass
1408.13
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
-
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
Benzenesulfonic acids and derivatives Naphthalenes 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Phenylhydrazines 1,3,5-triazine-2,4-diamines Aniline and substituted anilines Aryl ketones Benzylamines Chloro-s-triazines Aryl chlorides Vinylogous amides Sulfonyls Organosulfonic acids Heteroaromatic compounds Organic metal halides Azacyclic compounds Hydrazones Organic sodium salts Organochlorides Organic oxides Organic potassium salts Hydrocarbon derivatives Amines Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-benzylamino-s-triazine - Benzenesulfonate - Naphthalene - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Phenylhydrazine - 2,4-diamine-s-triazine - Aryl ketone - Aniline or substituted anilines - Benzylamine - Chloro-s-triazine - Halo-s-triazine - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Benzenoid - 1,3,5-triazine - Heteroaromatic compound - Organosulfonic acid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Vinylogous amide - Sulfonyl - Ketone - Organic metal halide - Azacycle - Hydrazone - Organic alkali metal salt - Amine - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic salt - Organic potassium salt - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - 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