Compound Identification
SMILES
CC1=C(C(C)=C(S1)C1=CC=C(C=C1)C#N)C1=C(C2=C(C)SC(=C2C)C2=CC=C(C=C2)C#N)C(F)(F)C(F)(F)C1(F)F
InChIKey
InChIKey=HVHLNBJBJYYQRE-UHFFFAOYSA-N
Formula
C31H20F6N2S2
Mass
598.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzonitriles
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzonitriles
Intermediate Tree Nodes
Not available
Direct Parent
Benzonitriles
Alternative Parents
Thiophenes Heteroaromatic compounds Nitriles Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzonitrile - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Nitrile - Carbonitrile - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.
External Descriptors
Not available