5-ethyl-4,6-dimethyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 5-ethyl-4,6-dimethyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyridine-3-carbonitrile Openeye Name: 5-ethyl-4,6-dimethyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyridine-3-carbonitrile CAS Name: 5-ethyl-4,6-dimethyl-2-[[3-(trifluoromethyl)phenyl]methylthio]-3-pyridinecarbonitrile IUPAC Name: 5-ethyl-4,6-dimethyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 5-ethyl-4,6-dimethyl-2-[[3-(trifluoromethyl)benzyl]thio]nicotinonitrile Formula: C18H17F3N2S MolecularWeight: 350.40119

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(C(=C1C)C#N)SCC2=CC(=CC=C2)C(F)(F)F)C

Isomeric SMILES

CCC1=C(N=C(C(=C1C)C#N)SCC2=CC(=CC=C2)C(F)(F)F)C

InChI

InChI=1S/C18H17F3N2S/c1-4-15-11(2)16(9-22)17(23-12(15)3)24-10-13-6-5-7-14(8-13)18(19,20)21/h5-8H,4,10H2,1-3H3