2-(4-methyl-6-oxidanidyl-pyrimidin-2-yl)sulfanylethanesulfonate

Systemtic Name: 2-(4-methyl-6-oxidanidyl-pyrimidin-2-yl)sulfanylethanesulfonate Openeye Name: 2-(4-methyl-6-oxido-pyrimidin-2-yl)sulfanylethanesulfonate CAS Name: 2-[(4-methyl-6-oxido-2-pyrimidinyl)thio]ethanesulfonate IUPAC Name: 2-(4-methyl-6-oxidopyrimidin-2-yl)sulfanylethanesulfonate Traditional Name: 2-[(4-methyl-6-oxido-pyrimidin-2-yl)thio]ethanesulfonate Formula: C7H8N2O4S2-2 MolecularWeight: 248.27942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCS(=O)(=O)[O-])[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCCS(=O)(=O)[O-])[O-]

InChI

InChI=1S/C7H10N2O4S2/c1-5-4-6(10)9-7(8-5)14-2-3-15(11,12)13/h4H,2-3H2,1H3,(H,8,9,10)(H,11,12,13)/p-2