2-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C19H19N2O2S2+ MolecularWeight: 371.49636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=CC(=O)[N+]2=CC=C1)COC3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

CC1=C2NC(=CC(=O)[N+]2=CC=C1)COC3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C19H18N2O2S2/c1-13-3-2-8-21-17(22)11-15(20-18(13)21)12-23-16-6-4-14(5-7-16)19-24-9-10-25-19/h2-8,11,19H,9-10,12H2,1H3/p+1