[2,6-bis(azanyl)-4-(4-methylpiperazin-1-yl)pyrimidin-1-ium-1-yl] hydrogen sulfate

Systemtic Name: [2,6-bis(azanyl)-4-(4-methylpiperazin-1-yl)pyrimidin-1-ium-1-yl] hydrogen sulfate Openeye Name: [2,6-diamino-4-(4-methylpiperazin-1-yl)pyrimidin-1-ium-1-yl] hydrogen sulfate CAS Name: sulfuric acid [2,6-diamino-4-(4-methyl-1-piperazinyl)-1-pyrimidin-1-iumyl] ester IUPAC Name: [2,6-diamino-4-(4-methylpiperazin-1-yl)pyrimidin-1-ium-1-yl] hydrogen sulfate Traditional Name: sulfuric acid [2,6-diamino-4-(4-methylpiperazino)pyrimidin-1-ium-1-yl] ester Formula: C9H17N6O4S+ MolecularWeight: 305.33408

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=[N+](C(=N2)N)OS(=O)(=O)O)N

Isomeric SMILES

CN1CCN(CC1)C2=CC(=[N+](C(=N2)N)OS(=O)(=O)O)N

InChI

InChI=1S/C9H16N6O4S/c1-13-2-4-14(5-3-13)8-6-7(10)15(9(11)12-8)19-20(16,17)18/h6H,2-5H2,1H3,(H4,10,11,12,16,17,18)/p+1