6-ethyl-5-fluoranyl-2-[1-(methylamino)pentan-3-ylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 6-ethyl-5-fluoranyl-2-[1-(methylamino)pentan-3-ylsulfanyl]pyridine-3-carbonitrile Openeye Name: 6-ethyl-2-[1-ethyl-3-(methylamino)propyl]sulfanyl-5-fluoro-pyridine-3-carbonitrile CAS Name: 6-ethyl-5-fluoro-2-[1-(methylamino)pentan-3-ylthio]-3-pyridinecarbonitrile IUPAC Name: 6-ethyl-5-fluoro-2-[1-(methylamino)pentan-3-ylsulfanyl]pyridine-3-carbonitrile Traditional Name: 6-ethyl-2-[[1-ethyl-3-(methylamino)propyl]thio]-5-fluoro-nicotinonitrile Formula: C14H20FN3S MolecularWeight: 281.392103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=N1)SC(CC)CCNC)C#N)F

Isomeric SMILES

CCC1=C(C=C(C(=N1)SC(CC)CCNC)C#N)F

InChI

InChI=1S/C14H20FN3S/c1-4-11(6-7-17-3)19-14-10(9-16)8-12(15)13(5-2)18-14/h8,11,17H,4-7H2,1-3H3