1-(4-fluorophenyl)-3,3-bis(methylsulfanyl)prop-2-en-1-one

Systemtic Name: 1-(4-fluorophenyl)-3,3-bis(methylsulfanyl)prop-2-en-1-one Openeye Name: 1-(4-fluorophenyl)-3,3-bis(methylsulfanyl)prop-2-en-1-one CAS Name: 1-(4-fluorophenyl)-3,3-bis(methylthio)-2-propen-1-one IUPAC Name: 1-(4-fluorophenyl)-3,3-bis(methylsulfanyl)prop-2-en-1-one Traditional Name: 1-(4-fluorophenyl)-3,3-bis(methylthio)prop-2-en-1-one Formula: C11H11FOS2 MolecularWeight: 242.332843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=CC(=O)C1=CC=C(C=C1)F)SC

Isomeric SMILES

CSC(=CC(=O)C1=CC=C(C=C1)F)SC

InChI

InChI=1S/C11H11FOS2/c1-14-11(15-2)7-10(13)8-3-5-9(12)6-4-8/h3-7H,1-2H3