2-[2-[5-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonylphenyl]propanoic acid

Systemtic Name: 2-[2-[5-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonylphenyl]propanoic acid Openeye Name: 2-[2-[5-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]benzimidazol-1-yl]sulfonylphenyl]propanoic acid CAS Name: 2-[2-[[5-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-1-benzimidazolyl]sulfonyl]phenyl]propanoic acid IUPAC Name: 2-[2-[5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonylphenyl]propanoic acid Traditional Name: 2-[2-[5-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]benzimidazol-1-yl]sulfonylphenyl]propionic acid Formula: C26H27N3O7S2 MolecularWeight: 557.63848

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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=CC=C4C(C)C(=O)O)C=CC(=C3)OC

Isomeric SMILES

CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2S(=O)(=O)C4=CC=CC=C4C(C)C(=O)O)C=CC(=C3)OC

InChI

InChI=1S/C26H27N3O7S2/c1-15-13-27-21(17(3)24(15)36-5)14-37(32)26-28-20-12-18(35-4)10-11-22(20)29(26)38(33,34)23-9-7-6-8-19(23)16(2)25(30)31/h6-13,16H,14H2,1-5H3,(H,30,31)