Compound Identification
SMILES
CCC1=C(NCC2=CC=C(C=C2)C2=CC=CC=C2C#N)N2N=CC=C2N=C1
InChIKey
InChIKey=NABFUHCHVZSGGP-UHFFFAOYSA-N
Formula
C22H19N5
Mass
353.429
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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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
Pyrazolo[1,5-a]pyrimidines Benzylamines Benzonitriles Aminopyrimidines and derivatives Pyrazoles Heteroaromatic compounds Nitriles Azacyclic compounds Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biphenylcarbonitrile - Pyrazolo[1,5-a]pyrimidine - Pyrazolopyrimidine - Benzonitrile - Benzylamine - Aminopyrimidine - Pyrimidine - Azole - Heteroaromatic compound - Pyrazole - Nitrile - Carbonitrile - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Cyanide - Amine - Aromatic heteropolycyclic 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