[2-oxidanylidene-2-(4-piperidin-1-ylsulfonylphenyl)ethyl] 2-(4-fluorophenyl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(4-piperidin-1-ylsulfonylphenyl)ethyl] 2-(4-fluorophenyl)sulfanylethanoate Openeye Name: [2-oxo-2-[4-(1-piperidylsulfonyl)phenyl]ethyl] 2-(4-fluorophenyl)sulfanylacetate CAS Name: 2-[(4-fluorophenyl)thio]acetic acid [2-oxo-2-[4-(1-piperidinylsulfonyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylsulfonylphenyl)ethyl] 2-(4-fluorophenyl)sulfanylacetate Traditional Name: 2-[(4-fluorophenyl)thio]acetic acid [2-keto-2-(4-piperidinosulfonylphenyl)ethyl] ester Formula: C21H22FNO5S2 MolecularWeight: 451.531483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)COC(=O)CSC3=CC=C(C=C3)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)COC(=O)CSC3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FNO5S2/c22-17-6-8-18(9-7-17)29-15-21(25)28-14-20(24)16-4-10-19(11-5-16)30(26,27)23-12-2-1-3-13-23/h4-11H,1-3,12-15H2