1-[2-fluoranyl-4-(hexadecylamino)phenyl]-2-methylsulfinyl-ethanone

Systemtic Name: 1-[2-fluoranyl-4-(hexadecylamino)phenyl]-2-methylsulfinyl-ethanone Openeye Name: 1-[2-fluoro-4-(hexadecylamino)phenyl]-2-methylsulfinyl-ethanone CAS Name: 1-[2-fluoro-4-(hexadecylamino)phenyl]-2-methylsulfinylethanone IUPAC Name: 1-[2-fluoro-4-(hexadecylamino)phenyl]-2-methylsulfinylethanone Traditional Name: 1-[4-(cetylamino)-2-fluoro-phenyl]-2-methylsulfinyl-ethanone Formula: C25H42FNO2S MolecularWeight: 439.669883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC(=C(C=C1)C(=O)CS(=O)C)F

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC(=C(C=C1)C(=O)CS(=O)C)F

InChI

InChI=1S/C25H42FNO2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-27-22-17-18-23(24(26)20-22)25(28)21-30(2)29/h17-18,20,27H,3-16,19,21H2,1-2H3