Compound Identification
SMILES
CCN(CC[N+](C)(C)C)C1=CC(C)=C(C=C1)N=NC1=NC(=NS1)C1=CC=CC=C1
InChIKey
InChIKey=OBOPQJVCYIBVIV-UHFFFAOYSA-N
Formula
C22H29N6S
Mass
409.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
- Level 5 Aminotoluenes
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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
Aminotoluenes
Alternative Parents
Dialkylarylamines Aniline and substituted anilines Thiadiazoles Tetraalkylammonium salts Heteroaromatic compounds Azo compounds Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aminotoluene - Azole - Quaternary ammonium salt - Thiadiazole - Tetraalkylammonium salt - Heteroaromatic compound - Azo compound - Tertiary amine - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group and one amino group.
External Descriptors
Not available