Compound Identification
SMILES
CC1=NC(NCC2=CC=CC=C2)=NC(NNC([O-])=NS(=O)(=O)C2=CC=CC=C2Cl)=N1
InChIKey
InChIKey=OJUGMCFGPCURKF-UHFFFAOYSA-M
Formula
C18H17ClN7O3S
Mass
446.89
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Triazines
-
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
Benzenesulfonamides Benzenesulfonyl compounds Benzylamines Sulfonylureas Secondary alkylarylamines Chlorobenzenes 1,3,5-triazines Aryl chlorides Sulfonyls Organosulfonic acids and derivatives Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives Organic oxides Organochlorides Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-benzylamino-s-triazine - Benzenesulfonamide - Benzenesulfonyl group - Benzylamine - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Sulfonylurea - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - 1,3,5-triazine - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Secondary amine - Azacycle - Amine - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organic anion - 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