9-methyl-2-[[(2-thiophen-2-ylphenyl)amino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 9-methyl-2-[[(2-thiophen-2-ylphenyl)amino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 9-methyl-2-[[2-(2-thienyl)anilino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 9-methyl-2-[(2-thiophen-2-ylanilino)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 9-methyl-2-[(2-thiophen-2-ylanilino)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 9-methyl-2-[[2-(2-thienyl)anilino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C20H18N3OS+ MolecularWeight: 348.44142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CNC3=CC=CC=C3C4=CC=CS4

Isomeric SMILES

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CNC3=CC=CC=C3C4=CC=CS4

InChI

InChI=1S/C20H17N3OS/c1-14-6-4-10-23-19(24)12-15(22-20(14)23)13-21-17-8-3-2-7-16(17)18-9-5-11-25-18/h2-12,21H,13H2,1H3/p+1