2-(sulfanylmethyl)-3-[4-(trifluoromethyl)phenyl]prop-1-en-1-one

Systemtic Name: 2-(sulfanylmethyl)-3-[4-(trifluoromethyl)phenyl]prop-1-en-1-one Openeye Name: 2-(sulfanylmethyl)-3-[4-(trifluoromethyl)phenyl]prop-1-en-1-one CAS Name: 2-(mercaptomethyl)-3-[4-(trifluoromethyl)phenyl]-1-propen-1-one IUPAC Name: 2-(sulfanylmethyl)-3-[4-(trifluoromethyl)phenyl]prop-1-en-1-one Traditional Name: 2-(mercaptomethyl)-3-[4-(trifluoromethyl)phenyl]prop-1-en-1-one Formula: C11H9F3OS MolecularWeight: 246.24877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=C=O)CS)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CC(=C=O)CS)C(F)(F)F

InChI

InChI=1S/C11H9F3OS/c12-11(13,14)10-3-1-8(2-4-10)5-9(6-15)7-16/h1-4,16H,5,7H2