Compound Identification
SMILES
NCCNC1=C(C#N)C(N)=C(S1)C(=O)C1=CC=CC=C1
InChIKey
InChIKey=HOHHFJGAKUMAPY-UHFFFAOYSA-N
Formula
C14H14N4OS
Mass
286.35
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Aryl-phenylketones
-
Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Aryl-phenylketones
Alternative Parents
3,4,5-trisubstituted-2-aminothiophenes Thiophene carboxylic acids and derivatives Benzoyl derivatives Vinylogous amides Heteroaromatic compounds Nitriles Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - 3,4,5-trisubstituted-2-aminothiophene - Benzoyl - Thiophene carboxylic acid or derivatives - Aminothiophene - Monocyclic benzene moiety - Benzenoid - 2-aminothiophene - Thiophene - Heteroaromatic compound - Vinylogous amide - Nitrile - Carbonitrile - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Cyanide - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available