2-[(2-methylsulfonylbenzimidazol-1-yl)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[(2-methylsulfonylbenzimidazol-1-yl)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(2-methylsulfonylbenzimidazol-1-yl)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(2-methylsulfonyl-1-benzimidazolyl)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(2-methylsulfonylbenzimidazol-1-yl)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(2-mesylbenzimidazol-1-yl)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C17H15N4O3S+ MolecularWeight: 355.391

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC2=CC=CC=C2N1CC3=CC(=O)[N+]4=CC=CC=C4N3

Isomeric SMILES

CS(=O)(=O)C1=NC2=CC=CC=C2N1CC3=CC(=O)[N+]4=CC=CC=C4N3

InChI

InChI=1S/C17H14N4O3S/c1-25(23,24)17-19-13-6-2-3-7-14(13)21(17)11-12-10-16(22)20-9-5-4-8-15(20)18-12/h2-10H,11H2,1H3/p+1