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

Systemtic Name: [7-fluoranyl-2-oxidanylidene-1-(2-phenylsulfanylethyl)quinolin-3-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [7-fluoro-2-oxo-1-(2-phenylsulfanylethyl)-3-quinolyl]methyl-methyl-(3-thienylmethyl)ammonium CAS Name: [7-fluoro-2-oxo-1-[2-(phenylthio)ethyl]-3-quinolinyl]methyl-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [7-fluoro-2-oxo-1-(2-phenylsulfanylethyl)quinolin-3-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [7-fluoro-2-keto-1-[2-(phenylthio)ethyl]-3-quinolyl]methyl-methyl-(3-thenyl)ammonium Formula: C24H24FN2OS2+ MolecularWeight: 439.588563

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)CC2=CC3=C(C=C(C=C3)F)N(C2=O)CCSC4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1=CSC=C1)CC2=CC3=C(C=C(C=C3)F)N(C2=O)CCSC4=CC=CC=C4

InChI

InChI=1S/C24H23FN2OS2/c1-26(15-18-9-11-29-17-18)16-20-13-19-7-8-21(25)14-23(19)27(24(20)28)10-12-30-22-5-3-2-4-6-22/h2-9,11,13-14,17H,10,12,15-16H2,1H3/p+1