Compound Identification
SMILES
CC1=C(NC(N)=O)C(Cl)=C(C(C#N)C2=CC=C(SC(F)(F)F)C=C2)C(Cl)=C1NC(N)=O
InChIKey
InChIKey=VPXUTMMKNIIRBO-UHFFFAOYSA-N
Formula
C18H14Cl2F3N5O2S
Mass
492.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Diphenylacetonitriles
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Diphenylacetonitriles
Intermediate Tree Nodes
Not available
Direct Parent
Diphenylacetonitriles
Alternative Parents
Diphenylmethanes Aromatic monoterpenoids N-phenylureas Monocyclic monoterpenoids Diaminotoluenes Thiophenol ethers Dichlorobenzenes Alkylarylthioethers Aryl chlorides Ureas Trihalomethanes Sulfenyl compounds Nitriles Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Diphenylacetonitrile - Diphenylmethane - P-cymene - Aromatic monoterpenoid - N-phenylurea - Monoterpenoid - Monocyclic monoterpenoid - Diaminotoluene - Aryl thioether - 1,3-dichlorobenzene - Thiophenol ether - Halobenzene - Chlorobenzene - Toluene - Alkylarylthioether - Aryl halide - Aryl chloride - Trihalomethane - Urea - Sulfenyl compound - Thioether - Carbonitrile - Nitrile - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Halomethane - Carbonyl group - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as diphenylacetonitriles. These are cyclic aromatic compounds containing a diphenylacetonitrile moiety, which consists of a diphenylmethane linked to and acetonitrile to form 2,2-diphenylacetonitrile.
External Descriptors
Not available