thiophen-2-yl 2-ethyl-8-fluoranyl-3-[(4-fluorophenyl)sulfonylamino]octanoate

Systemtic Name: thiophen-2-yl 2-ethyl-8-fluoranyl-3-[(4-fluorophenyl)sulfonylamino]octanoate Openeye Name: 2-thienyl 2-ethyl-8-fluoro-3-[(4-fluorophenyl)sulfonylamino]octanoate CAS Name: 2-ethyl-8-fluoro-3-[(4-fluorophenyl)sulfonylamino]octanoic acid thiophen-2-yl ester IUPAC Name: thiophen-2-yl 2-ethyl-8-fluoro-3-[(4-fluorophenyl)sulfonylamino]octanoate Traditional Name: 2-ethyl-8-fluoro-3-[(4-fluorophenyl)sulfonylamino]caprylic acid 2-thienyl ester Formula: C20H25F2NO4S2 MolecularWeight: 445.543606

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CCCCCF)NS(=O)(=O)C1=CC=C(C=C1)F)C(=O)OC2=CC=CS2

Isomeric SMILES

CCC(C(CCCCCF)NS(=O)(=O)C1=CC=C(C=C1)F)C(=O)OC2=CC=CS2

InChI

InChI=1S/C20H25F2NO4S2/c1-2-17(20(24)27-19-8-6-14-28-19)18(7-4-3-5-13-21)23-29(25,26)16-11-9-15(22)10-12-16/h6,8-12,14,17-18,23H,2-5,7,13H2,1H3