2-[[1-(phenylmethyl)imidazol-2-yl]sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[[1-(phenylmethyl)imidazol-2-yl]sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(1-benzylimidazol-2-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[[1-(phenylmethyl)-2-imidazolyl]thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(1-benzylimidazol-2-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[(1-benzylimidazol-2-yl)thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C19H17N4OS+ MolecularWeight: 349.42948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CN=C2SCC3=CC(=O)[N+]4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CN=C2SCC3=CC(=O)[N+]4=CC=CC=C4N3

InChI

InChI=1S/C19H16N4OS/c24-18-12-16(21-17-8-4-5-10-23(17)18)14-25-19-20-9-11-22(19)13-15-6-2-1-3-7-15/h1-12H,13-14H2/p+1