[7-fluoranyl-2-oxidanylidene-1-(2-phenylsulfanylethyl)quinolin-3-yl]methyl-(furan-2-ylmethyl)-methyl-azanium

Systemtic Name: [7-fluoranyl-2-oxidanylidene-1-(2-phenylsulfanylethyl)quinolin-3-yl]methyl-(furan-2-ylmethyl)-methyl-azanium Openeye Name: [7-fluoro-2-oxo-1-(2-phenylsulfanylethyl)-3-quinolyl]methyl-(2-furylmethyl)-methyl-ammonium CAS Name: [7-fluoro-2-oxo-1-[2-(phenylthio)ethyl]-3-quinolinyl]methyl-(2-furanylmethyl)-methylammonium IUPAC Name: [7-fluoro-2-oxo-1-(2-phenylsulfanylethyl)quinolin-3-yl]methyl-(furan-2-ylmethyl)-methylazanium Traditional Name: [7-fluoro-2-keto-1-[2-(phenylthio)ethyl]-3-quinolyl]methyl-(2-furfuryl)-methyl-ammonium Formula: C24H24FN2O2S+ MolecularWeight: 423.522963

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CO1)CC2=CC3=C(C=C(C=C3)F)N(C2=O)CCSC4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1=CC=CO1)CC2=CC3=C(C=C(C=C3)F)N(C2=O)CCSC4=CC=CC=C4

InChI

InChI=1S/C24H23FN2O2S/c1-26(17-21-6-5-12-29-21)16-19-14-18-9-10-20(25)15-23(18)27(24(19)28)11-13-30-22-7-3-2-4-8-22/h2-10,12,14-15H,11,13,16-17H2,1H3/p+1