Sarolaner

Product Specifications

CAS Number

1398609-39-6

Synonyms

Ethanone, 1-[5'-[(5S)-5-(3,5-dichloro-4-fluorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]spiro[azetidine-3,1'(3'H)-isobenzofuran]-1-yl]-2-(methylsulfonyl)-; 1-[5'-[(5S)-5-(3,5-Dichloro-4-fluorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]spiro[azetidine-3,1'(3'H)-isobenzofuran]-1-yl]-2-(methylsulfonyl)ethanone; PF 6450567; Sarolaner

Hazard Statement

Harmful if swallowed; UN number: UN3077; Packing Group: III

Purity

>95% (HPLC)

Smiles

CS(=O)(=O)CC(=O)N1CC2(C1)OCc3cc(ccc23)C4=NO[C@@](C4)(c5cc(Cl)c(F)c(Cl)c5)C(F)(F)F

Molecular Formula

C23 H18 Cl2 F4 N2 O5 S

Molecular Weight

581.36

InChI

InChI=1S/C23H18Cl2F4N2O5S/c1-37(33,34)9-19(32)31-10-21(11-31)15-3-2-12(4-13(15)8-35-21)18-7-22(36-30-18,23(27,28)29)14-5-16(24)20(26)17(25)6-14/h2-6H,7-11H2,1H3/t22-/m0/s1

Additionnal Information

IUPAC name: 1-[6-[(5S)-5-(3,5-dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]spiro[1H-2-benzofuran-3,3'-azetidine]-1'-yl]-2-methylsulfonylethanone