3-tert-butylsulfanyl-1-(4-fluorophenyl)propan-1-one

Systemtic Name: 3-tert-butylsulfanyl-1-(4-fluorophenyl)propan-1-one Openeye Name: 3-tert-butylsulfanyl-1-(4-fluorophenyl)propan-1-one CAS Name: 3-(tert-butylthio)-1-(4-fluorophenyl)-1-propanone IUPAC Name: 3-tert-butylsulfanyl-1-(4-fluorophenyl)propan-1-one Traditional Name: 3-(tert-butylthio)-1-(4-fluorophenyl)propan-1-one Formula: C13H17FOS MolecularWeight: 240.336883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCCC(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CC(C)(C)SCCC(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C13H17FOS/c1-13(2,3)16-9-8-12(15)10-4-6-11(14)7-5-10/h4-7H,8-9H2,1-3H3