1-[[3-(3-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]oxymethylsulfanyl]cyclopentan-1-ol

Systemtic Name: 1-[[3-(3-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]oxymethylsulfanyl]cyclopentan-1-ol Openeye Name: 1-[[3-(3-methylsulfonylphenyl)-5-(trifluoromethyl)-2-pyridyl]oxymethylsulfanyl]cyclopentanol CAS Name: 1-[[3-(3-methylsulfonylphenyl)-5-(trifluoromethyl)-2-pyridinyl]oxymethylthio]-1-cyclopentanol IUPAC Name: 1-[[3-(3-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]oxymethylsulfanyl]cyclopentan-1-ol Traditional Name: 1-[[3-(3-mesylphenyl)-5-(trifluoromethyl)-2-pyridyl]oxymethylthio]cyclopentanol Formula: C19H20F3NO4S2 MolecularWeight: 447.49161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C2=CC(=CN=C2OCSC3(CCCC3)O)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C2=CC(=CN=C2OCSC3(CCCC3)O)C(F)(F)F

InChI

InChI=1S/C19H20F3NO4S2/c1-29(25,26)15-6-4-5-13(9-15)16-10-14(19(20,21)22)11-23-17(16)27-12-28-18(24)7-2-3-8-18/h4-6,9-11,24H,2-3,7-8,12H2,1H3