2-(3-methylsulfonylphenyl)-3-(2-oxidanylsulfanylethoxy)-5-(trifluoromethyl)pyridine

Systemtic Name: 2-(3-methylsulfonylphenyl)-3-(2-oxidanylsulfanylethoxy)-5-(trifluoromethyl)pyridine Openeye Name: 3-(2-hydroxysulfanylethoxy)-2-(3-methylsulfonylphenyl)-5-(trifluoromethyl)pyridine CAS Name: 2-[[2-(3-methylsulfonylphenyl)-5-(trifluoromethyl)-3-pyridinyl]oxy]ethanesulfenic acid IUPAC Name: 3-(2-hydroxysulfanylethoxy)-2-(3-methylsulfonylphenyl)-5-(trifluoromethyl)pyridine Traditional Name: 2-(3-mesylphenyl)-3-(2-sulfenoethoxy)-5-(trifluoromethyl)pyridine Formula: C15H14F3NO4S2 MolecularWeight: 393.40117

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C2=C(C=C(C=N2)C(F)(F)F)OCCSO

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C2=C(C=C(C=N2)C(F)(F)F)OCCSO

InChI

InChI=1S/C15H14F3NO4S2/c1-25(21,22)12-4-2-3-10(7-12)14-13(23-5-6-24-20)8-11(9-19-14)15(16,17)18/h2-4,7-9,20H,5-6H2,1H3