Compound Identification
SMILES
COCCN1N=NN=C1[C@H]([NH+](CC1=CC=CO1)CC1=CC=CS1)C1=CC=C(C)C=C1
InChIKey
InChIKey=PWLSUVYZUIRFFX-OAQYLSRUSA-O
Formula
C22H26N5O2S
Mass
424.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Toluenes
Alternative Parents
Aralkylamines Thiophenes Tetrazoles Quaternary ammonium salts Heteroaromatic compounds Furans Trialkylamines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Toluene - Aralkylamine - Azole - Furan - Quaternary ammonium salt - Tetrazole - Thiophene - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Ether - Dialkyl ether - Organoheterocyclic compound - Azacycle - Oxacycle - Organic nitrogen compound - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.
External Descriptors
Not available