4-methylsulfanyl-2-oxidanylidene-6-phenyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carbonitrile

Systemtic Name: 4-methylsulfanyl-2-oxidanylidene-6-phenyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carbonitrile Openeye Name: 4-methylsulfanyl-2-oxo-6-phenyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carbonitrile CAS Name: 4-(methylthio)-2-oxo-6-phenyl-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinecarbonitrile IUPAC Name: 4-methylsulfanyl-2-oxo-6-phenyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carbonitrile Traditional Name: 2-keto-4-(methylthio)-6-phenyl-1-[3-(trifluoromethyl)benzyl]nicotinonitrile Formula: C21H15F3N2OS MolecularWeight: 400.41681

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)N(C(=C1)C2=CC=CC=C2)CC3=CC(=CC=C3)C(F)(F)F)C#N

Isomeric SMILES

CSC1=C(C(=O)N(C(=C1)C2=CC=CC=C2)CC3=CC(=CC=C3)C(F)(F)F)C#N

InChI

InChI=1S/C21H15F3N2OS/c1-28-19-11-18(15-7-3-2-4-8-15)26(20(27)17(19)12-25)13-14-6-5-9-16(10-14)21(22,23)24/h2-11H,13H2,1H3