Compound Identification
SMILES
CC1=NN(C(=O)\C1=C/N1CCN(CC1)\C=C1/C(C)=NN(C1=O)C1=CC=C(C)C=C1)C1=CC=C(C)C=C1
InChIKey
InChIKey=IKQOXLWRKPWUSB-WTHRLWDASA-N
Formula
C28H30N6O2
Mass
482.588
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
Pyrazolones Piperazines Vinylogous amides Trialkylamines Amino acids and derivatives Enamines Azacyclic compounds Allylamines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Toluene - 1,4-diazinane - Piperazine - Pyrazolinone - Pyrazoline - Vinylogous amide - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Allylamine - Carboxylic acid derivative - Enamine - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic nitrogen compound - 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