1-butylsulfonyl-5-[[2,4,5-tris(fluoranyl)phenyl]methoxymethyl]pyrrolidine-3-thiol

Systemtic Name: 1-butylsulfonyl-5-[[2,4,5-tris(fluoranyl)phenyl]methoxymethyl]pyrrolidine-3-thiol Openeye Name: 1-butylsulfonyl-5-[(2,4,5-trifluorophenyl)methoxymethyl]pyrrolidine-3-thiol CAS Name: 1-butylsulfonyl-5-[(2,4,5-trifluorophenyl)methoxymethyl]-3-pyrrolidinethiol IUPAC Name: 1-butylsulfonyl-5-[(2,4,5-trifluorophenyl)methoxymethyl]pyrrolidine-3-thiol Traditional Name: 1-butylsulfonyl-5-[(2,4,5-trifluorobenzyl)oxymethyl]pyrrolidine-3-thiol Formula: C16H22F3NO3S2 MolecularWeight: 397.47599

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22F3NO3S2/c1-2-3-4-25(21,22)20-8-13(24)6-12(20)10-23-9-11-5-15(18)16(19)7-14(11)17/h5,7,12-13,24H,2-4,6,8-10H2,1H3