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

Systemtic Name: 2-(4-methylsulfonylpiperazin-1-yl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-(4-methylsulfonylpiperazin-1-yl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-(4-methylsulfonyl-1-piperazinyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-(4-methylsulfonylpiperazin-1-yl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-(4-mesylpiperazino)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C13H17N4O3S+ MolecularWeight: 309.36408

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC(=O)[N+]3=CC=CC=C3N2

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC(=O)[N+]3=CC=CC=C3N2

InChI

InChI=1S/C13H16N4O3S/c1-21(19,20)16-8-6-15(7-9-16)12-10-13(18)17-5-3-2-4-11(17)14-12/h2-5,10H,6-9H2,1H3/p+1