1-(4-methoxypyrimidin-2-yl)-1,2,4-triazole-3-sulfonic acid

Systemtic Name: 1-(4-methoxypyrimidin-2-yl)-1,2,4-triazole-3-sulfonic acid Openeye Name: 1-(4-methoxypyrimidin-2-yl)-1,2,4-triazole-3-sulfonic acid CAS Name: 1-(4-methoxy-2-pyrimidinyl)-1,2,4-triazole-3-sulfonic acid IUPAC Name: 1-(4-methoxypyrimidin-2-yl)-1,2,4-triazole-3-sulfonic acid Traditional Name: 1-(4-methoxypyrimidin-2-yl)-1,2,4-triazole-3-sulfonic acid Formula: C7H7N5O4S MolecularWeight: 257.22658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1)N2C=NC(=N2)S(=O)(=O)O

Isomeric SMILES

COC1=NC(=NC=C1)N2C=NC(=N2)S(=O)(=O)O

InChI

InChI=1S/C7H7N5O4S/c1-16-5-2-3-8-6(10-5)12-4-9-7(11-12)17(13,14)15/h2-4H,1H3,(H,13,14,15)