N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Formula: C18H17FN3O2S+ MolecularWeight: 358.409883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)C2=CNC3=CC=CC=[N+]3C2=O)F

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)C2=CNC3=CC=CC=[N+]3C2=O)F

InChI

InChI=1S/C18H16FN3O2S/c19-15-6-2-1-5-13(15)12-25-10-8-20-17(23)14-11-21-16-7-3-4-9-22(16)18(14)24/h1-7,9,11H,8,10,12H2,(H,20,23)/p+1