4-[3-(fluoranylmethylsulfanyl)phenyl]-2-hexyl-5-(methylamino)thiophen-3-one

Systemtic Name: 4-[3-(fluoranylmethylsulfanyl)phenyl]-2-hexyl-5-(methylamino)thiophen-3-one Openeye Name: 4-[3-(fluoromethylsulfanyl)phenyl]-2-hexyl-5-(methylamino)thiophen-3-one CAS Name: 4-[3-(fluoromethylthio)phenyl]-2-hexyl-5-(methylamino)-3-thiophenone IUPAC Name: 4-[3-(fluoromethylsulfanyl)phenyl]-2-hexyl-5-(methylamino)thiophen-3-one Traditional Name: 4-[3-(fluoromethylthio)phenyl]-2-hexyl-5-(methylamino)thiophen-3-one Formula: C18H24FNOS2 MolecularWeight: 353.517663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(=O)C(=C(S1)NC)C2=CC(=CC=C2)SCF

Isomeric SMILES

CCCCCCC1C(=O)C(=C(S1)NC)C2=CC(=CC=C2)SCF

InChI

InChI=1S/C18H24FNOS2/c1-3-4-5-6-10-15-17(21)16(18(20-2)23-15)13-8-7-9-14(11-13)22-12-19/h7-9,11,15,20H,3-6,10,12H2,1-2H3