1-[2,4-bis(fluoranyl)phenyl]-5-oxidanylidene-N-(3-phenylsulfanylpropyl)pyrrolidine-3-carboxamide

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-5-oxidanylidene-N-(3-phenylsulfanylpropyl)pyrrolidine-3-carboxamide Openeye Name: 1-(2,4-difluorophenyl)-5-oxo-N-(3-phenylsulfanylpropyl)pyrrolidine-3-carboxamide CAS Name: 1-(2,4-difluorophenyl)-5-oxo-N-[3-(phenylthio)propyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(2,4-difluorophenyl)-5-oxo-N-(3-phenylsulfanylpropyl)pyrrolidine-3-carboxamide Traditional Name: 1-(2,4-difluorophenyl)-5-keto-N-[3-(phenylthio)propyl]pyrrolidine-3-carboxamide Formula: C20H20F2N2O2S MolecularWeight: 390.446806

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=C(C=C(C=C2)F)F)C(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

C1C(CN(C1=O)C2=C(C=C(C=C2)F)F)C(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C20H20F2N2O2S/c21-15-7-8-18(17(22)12-15)24-13-14(11-19(24)25)20(26)23-9-4-10-27-16-5-2-1-3-6-16/h1-3,5-8,12,14H,4,9-11,13H2,(H,23,26)