disodium 5-[6-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonyl-2-(2-oxidanidyl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: disodium 5-[6-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonyl-2-(2-oxidanidyl-2-oxidanylidene-ethoxy)benzoate Openeye Name: disodium 5-[6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]benzimidazol-1-yl]sulfonyl-2-(2-oxido-2-oxo-ethoxy)benzoate CAS Name: disodium 5-[[6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-1-benzimidazolyl]sulfonyl]-2-(2-oxido-2-oxoethoxy)benzoate IUPAC Name: disodium 5-[6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonyl-2-(2-oxido-2-oxoethoxy)benzoate Traditional Name: disodium 2-(2-keto-2-oxido-ethoxy)-5-[6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]benzimidazol-1-yl]sulfonyl-benzoate Formula: C26H23N3Na2O10S2 MolecularWeight: 647.58446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2S(=O)(=O)C4=CC(=C(C=C4)OCC(=O)[O-])C(=O)[O-])C=C(C=C3)OC.[Na+].[Na+]

Isomeric SMILES

CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2S(=O)(=O)C4=CC(=C(C=C4)OCC(=O)[O-])C(=O)[O-])C=C(C=C3)OC.[Na+].[Na+]

InChI

InChI=1S/C26H25N3O10S2.2Na/c1-14-11-27-20(15(2)24(14)38-4)13-40(34)26-28-19-7-5-16(37-3)9-21(19)29(26)41(35,36)17-6-8-22(39-12-23(30)31)18(10-17)25(32)33;;/h5-11H,12-13H2,1-4H3,(H,30,31)(H,32,33);;/q;2*+1/p-2