N-[2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylethyl]-4-fluoranyl-N-methyl-benzenesulfonamide

Systemtic Name: N-[2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylethyl]-4-fluoranyl-N-methyl-benzenesulfonamide Openeye Name: N-[2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylethyl]-4-fluoro-N-methyl-benzenesulfonamide CAS Name: N-[2-[[2-(4-ethoxyphenyl)-1-pyrrolidinyl]sulfonyl]ethyl]-4-fluoro-N-methylbenzenesulfonamide IUPAC Name: N-[2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylethyl]-4-fluoro-N-methylbenzenesulfonamide Traditional Name: 4-fluoro-N-methyl-N-[2-(2-p-phenetylpyrrolidino)sulfonylethyl]benzenesulfonamide Formula: C21H27FN2O5S2 MolecularWeight: 470.577883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2S(=O)(=O)CCN(C)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2S(=O)(=O)CCN(C)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H27FN2O5S2/c1-3-29-19-10-6-17(7-11-19)21-5-4-14-24(21)30(25,26)16-15-23(2)31(27,28)20-12-8-18(22)9-13-20/h6-13,21H,3-5,14-16H2,1-2H3