[4-methyl-6-[(1-methyl-6-oxidanylidene-3H-pyridazin-1-ium-3-yl)oxy]pyrimidin-2-yl] carbamimidothioate

Systemtic Name: [4-methyl-6-[(1-methyl-6-oxidanylidene-3H-pyridazin-1-ium-3-yl)oxy]pyrimidin-2-yl] carbamimidothioate Openeye Name: 2-[4-methyl-6-[(1-methyl-6-oxo-3H-pyridazin-1-ium-3-yl)oxy]pyrimidin-2-yl]isothiourea CAS Name: carbamimidothioic acid [4-methyl-6-[(1-methyl-6-oxo-3H-pyridazin-1-ium-3-yl)oxy]-2-pyrimidinyl] ester IUPAC Name: [4-methyl-6-[(1-methyl-6-oxo-3H-pyridazin-1-ium-3-yl)oxy]pyrimidin-2-yl] carbamimidothioate Traditional Name: 2-[4-[(6-keto-1-methyl-3H-pyridazin-1-ium-3-yl)oxy]-6-methyl-pyrimidin-2-yl]isothiourea Formula: C11H13N6O2S+ MolecularWeight: 293.32492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(=N)N)OC2C=CC(=O)[N+](=N2)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC(=N)N)OC2C=CC(=O)[N+](=N2)C

InChI

InChI=1S/C11H13N6O2S/c1-6-5-8(15-11(14-6)20-10(12)13)19-7-3-4-9(18)17(2)16-7/h3-5,7H,1-2H3,(H3,12,13)/q+1