6-[4-[(4-fluorophenyl)methoxy]phenyl]-2-propylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-[4-[(4-fluorophenyl)methoxy]phenyl]-2-propylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-[4-[(4-fluorophenyl)methoxy]phenyl]-2-propylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-[4-[(4-fluorophenyl)methoxy]phenyl]-2-(propylthio)-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-[4-[(4-fluorophenyl)methoxy]phenyl]-2-propylsulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 6-[4-(4-fluorobenzyl)oxyphenyl]-2-(propylthio)-4-(trifluoromethyl)nicotinonitrile Formula: C23H18F4N2OS MolecularWeight: 446.460433

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C(=CC(=N1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)F)C(F)(F)F)C#N

Isomeric SMILES

CCCSC1=C(C(=CC(=N1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)F)C(F)(F)F)C#N

InChI

InChI=1S/C23H18F4N2OS/c1-2-11-31-22-19(13-28)20(23(25,26)27)12-21(29-22)16-5-9-18(10-6-16)30-14-15-3-7-17(24)8-4-15/h3-10,12H,2,11,14H2,1H3