5-[2-[[2,5-bis(fluoranyl)phenyl]methylamino]ethyl]-1-naphthalen-2-ylsulfonyl-pyrrolidine-3-thiol

Systemtic Name: 5-[2-[[2,5-bis(fluoranyl)phenyl]methylamino]ethyl]-1-naphthalen-2-ylsulfonyl-pyrrolidine-3-thiol Openeye Name: 5-[2-[(2,5-difluorophenyl)methylamino]ethyl]-1-(2-naphthylsulfonyl)pyrrolidine-3-thiol CAS Name: 5-[2-[(2,5-difluorophenyl)methylamino]ethyl]-1-(2-naphthalenylsulfonyl)-3-pyrrolidinethiol IUPAC Name: 5-[2-[(2,5-difluorophenyl)methylamino]ethyl]-1-naphthalen-2-ylsulfonylpyrrolidine-3-thiol Traditional Name: 5-[2-[(2,5-difluorobenzyl)amino]ethyl]-1-(2-naphthylsulfonyl)pyrrolidine-3-thiol Formula: C23H24F2N2O2S2 MolecularWeight: 462.575666

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1CCNCC2=C(C=CC(=C2)F)F)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

Isomeric SMILES

C1C(CN(C1CCNCC2=C(C=CC(=C2)F)F)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

InChI

InChI=1S/C23H24F2N2O2S2/c24-19-6-8-23(25)18(11-19)14-26-10-9-20-13-21(30)15-27(20)31(28,29)22-7-5-16-3-1-2-4-17(16)12-22/h1-8,11-12,20-21,26,30H,9-10,13-15H2