Compound Identification
SMILES
ClC1=C(Cl)C=C2N=C(CCC(C3CCN(CC4=CC=CC=C4)CC3)C3=CC=C(C=C3)C3=CC=CC(=C3)C#N)NC2=C1
InChIKey
InChIKey=PDQUJGCBFQVRJR-UHFFFAOYSA-N
Formula
C35H32Cl2N4
Mass
579.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Biphenyls and derivatives
- Level 5 Biphenylcarbonitriles
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Subclass
Biphenyls and derivatives
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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
N-benzylpiperidines Aromatic monoterpenoids Bicyclic monoterpenoids Benzimidazoles Phenylmethylamines Benzonitriles Benzylamines Aralkylamines Aryl chlorides Imidazoles Heteroaromatic compounds Trialkylamines Azacyclic compounds Nitriles Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biphenylcarbonitrile - N-benzylpiperidine - Benzylpiperidine - P-cymene - Aromatic monoterpenoid - Bicyclic monoterpenoid - Monoterpenoid - Benzimidazole - Benzonitrile - Benzylamine - Phenylmethylamine - Aralkylamine - Piperidine - Aryl chloride - Aryl halide - Azole - Heteroaromatic compound - Imidazole - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Organohalogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Cyanide - 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