3-oxidanylidene-3-[4-(trifluoromethylsulfanyl)phenyl]propanenitrile

Systemtic Name: 3-oxidanylidene-3-[4-(trifluoromethylsulfanyl)phenyl]propanenitrile Openeye Name: 3-oxo-3-[4-(trifluoromethylsulfanyl)phenyl]propanenitrile CAS Name: 3-oxo-3-[4-(trifluoromethylthio)phenyl]propanenitrile IUPAC Name: 3-oxo-3-[4-(trifluoromethylsulfanyl)phenyl]propanenitrile Traditional Name: 3-keto-3-[4-(trifluoromethylthio)phenyl]propionitrile Formula: C10H6F3NOS MolecularWeight: 245.22095

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CC#N)SC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CC#N)SC(F)(F)F

InChI

InChI=1S/C10H6F3NOS/c11-10(12,13)16-8-3-1-7(2-4-8)9(15)5-6-14/h1-4H,5H2