N-butyl-4-sulfanyl-2-[[2,4,5-tris(fluoranyl)phenyl]methoxymethyl]pyrrolidine-1-sulfonamide

Systemtic Name: N-butyl-4-sulfanyl-2-[[2,4,5-tris(fluoranyl)phenyl]methoxymethyl]pyrrolidine-1-sulfonamide Openeye Name: N-butyl-4-sulfanyl-2-[(2,4,5-trifluorophenyl)methoxymethyl]pyrrolidine-1-sulfonamide CAS Name: N-butyl-4-mercapto-2-[(2,4,5-trifluorophenyl)methoxymethyl]-1-pyrrolidinesulfonamide IUPAC Name: N-butyl-4-sulfanyl-2-[(2,4,5-trifluorophenyl)methoxymethyl]pyrrolidine-1-sulfonamide Traditional Name: N-butyl-4-mercapto-2-[(2,4,5-trifluorobenzyl)oxymethyl]pyrrolidine-1-sulfonamide Formula: C16H23F3N2O3S2 MolecularWeight: 412.49063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)N1CC(CC1COCC2=CC(=C(C=C2F)F)F)S

Isomeric SMILES

CCCCNS(=O)(=O)N1CC(CC1COCC2=CC(=C(C=C2F)F)F)S

InChI

InChI=1S/C16H23F3N2O3S2/c1-2-3-4-20-26(22,23)21-8-13(25)6-12(21)10-24-9-11-5-15(18)16(19)7-14(11)17/h5,7,12-13,20,25H,2-4,6,8-10H2,1H3