2-pentylsulfanyl-6-pyridin-4-yl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-pentylsulfanyl-6-pyridin-4-yl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-pentylsulfanyl-6-(4-pyridyl)-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-(pentylthio)-6-pyridin-4-yl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-pentylsulfanyl-6-pyridin-4-yl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-(amylthio)-6-(4-pyridyl)-4-(trifluoromethyl)nicotinonitrile Formula: C17H16F3N3S MolecularWeight: 351.38925

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=C(C(=CC(=N1)C2=CC=NC=C2)C(F)(F)F)C#N

Isomeric SMILES

CCCCCSC1=C(C(=CC(=N1)C2=CC=NC=C2)C(F)(F)F)C#N

InChI

InChI=1S/C17H16F3N3S/c1-2-3-4-9-24-16-13(11-21)14(17(18,19)20)10-15(23-16)12-5-7-22-8-6-12/h5-8,10H,2-4,9H2,1H3