Compound Identification
SMILES
N#CC1=CC=C(C=C1)C1=CC(NC2=NC=CC(=N2)C2=NC=CS2)=CC=C1
InChIKey
InChIKey=ZXAJNZQNJMEUSH-UHFFFAOYSA-N
Formula
C20H13N5S
Mass
355.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Biphenyls and derivatives
- Level 5 Biphenylcarbonitriles
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Subclass
Biphenyls and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Biphenylcarbonitriles
Alternative Parents
Benzonitriles Aniline and substituted anilines Aminopyrimidines and derivatives Thiazoles Heteroaromatic compounds Secondary amines Nitriles Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Biphenylcarbonitrile - Benzonitrile - Aniline or substituted anilines - Aminopyrimidine - Pyrimidine - Heteroaromatic compound - Thiazole - Azole - Azacycle - Organoheterocyclic compound - Secondary amine - Nitrile - Carbonitrile - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Cyanide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as biphenylcarbonitriles. These are organic compounds containing an acetonitrile with one hydrogen replaced by a biphenyl group.
External Descriptors
Not available