Compound Identification
SMILES
CSC1=CC=CC=C1CNC1=NC=C(C(NCC2=CC=C(CN(C)C)C=C2)=N1)[N+]([O-])=O
InChIKey
InChIKey=GKACIZWRFYXDAO-UHFFFAOYSA-N
Formula
C22H26N6O2S
Mass
438.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylmethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmethylamines
Alternative Parents
Benzylamines Nitroaromatic compounds Thiophenol ethers Aminopyrimidines and derivatives Alkylarylthioethers Aralkylamines Imidolactams Heteroaromatic compounds Trialkylamines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Sulfenyl compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl thioether - Nitroaromatic compound - Benzylamine - Phenylmethylamine - Thiophenol ether - Aminopyrimidine - Alkylarylthioether - Aralkylamine - Pyrimidine - Imidolactam - Heteroaromatic compound - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Sulfenyl compound - Azacycle - Organic 1,3-dipolar compound - Thioether - Organic oxoazanium - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organic oxygen compound - Organic salt - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
External Descriptors
Not available