2-[[[[(4,6-dimethoxypyrimidin-2-yl)amino]-oxidanidyl-methylidene]amino]sulfonylmethyl]benzoate

Systemtic Name: 2-[[[[(4,6-dimethoxypyrimidin-2-yl)amino]-oxidanidyl-methylidene]amino]sulfonylmethyl]benzoate Openeye Name: 2-[[[[(4,6-dimethoxypyrimidin-2-yl)amino]-oxido-methylene]amino]sulfonylmethyl]benzoate CAS Name: 2-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxidomethylidene]amino]sulfonylmethyl]benzoate IUPAC Name: 2-[[[[(4,6-dimethoxypyrimidin-2-yl)amino]-oxidomethylidene]amino]sulfonylmethyl]benzoate Traditional Name: 2-[[[[(4,6-dimethoxypyrimidin-2-yl)amino]-oxido-methylene]amino]sulfonylmethyl]benzoate Formula: C15H14N4O7S-2 MolecularWeight: 394.35926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=NS(=O)(=O)CC2=CC=CC=C2C(=O)[O-])[O-])OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=NS(=O)(=O)CC2=CC=CC=C2C(=O)[O-])[O-])OC

InChI

InChI=1S/C15H16N4O7S/c1-25-11-7-12(26-2)17-14(16-11)18-15(22)19-27(23,24)8-9-5-3-4-6-10(9)13(20)21/h3-7H,8H2,1-2H3,(H,20,21)(H2,16,17,18,19,22)/p-2