Compound Identification
SMILES
CCNC1=NC(S[C@@H](C)C(=O)OC)=NC(NCC2=CC=CC=C2)=N1
InChIKey
InChIKey=NBCSEJOKYIIKRK-NSHDSACASA-N
Formula
C16H21N5O2S
Mass
347.44
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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
-
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
Benzylamines Alkyl-2-thio-S-triazines 1,3,5-triazine-2,4-diamines Secondary alkylarylamines Alkylarylthioethers Methyl esters Heteroaromatic compounds Amino acids and derivatives Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-benzylamino-s-triazine - 2,4-diamine-s-triazine - Alkyl-2-thio-s-triazine - Aryl thioether - Benzylamine - Secondary aliphatic/aromatic amine - Alkylarylthioether - Monocyclic benzene moiety - 1,3,5-triazine - Benzenoid - Heteroaromatic compound - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Secondary amine - Thioether - Sulfenyl compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Carbonyl group - 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