N-(3-fluorophenyl)-3-[(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]propanamide

Systemtic Name: N-(3-fluorophenyl)-3-[(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]propanamide Openeye Name: N-(3-fluorophenyl)-3-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]propanamide CAS Name: N-(3-fluorophenyl)-3-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]propanamide IUPAC Name: N-(3-fluorophenyl)-3-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]propanamide Traditional Name: N-(3-fluorophenyl)-3-[(4-keto-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]propionamide Formula: C19H19FN3O2S+ MolecularWeight: 372.436463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSCCC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSCCC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C19H18FN3O2S/c1-13-5-6-17-21-16(10-19(25)23(17)11-13)12-26-8-7-18(24)22-15-4-2-3-14(20)9-15/h2-6,9-11H,7-8,12H2,1H3,(H,22,24)/p+1