3-[2-methoxy-5-[6-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonyl-phenyl]propanoic acid

Systemtic Name: 3-[2-methoxy-5-[6-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonyl-phenyl]propanoic acid Openeye Name: 3-[2-methoxy-5-[6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]benzimidazol-1-yl]sulfonyl-phenyl]propanoic acid CAS Name: 3-[2-methoxy-5-[[6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-1-benzimidazolyl]sulfonyl]phenyl]propanoic acid IUPAC Name: 3-[2-methoxy-5-[6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonylphenyl]propanoic acid Traditional Name: 3-[2-methoxy-5-[6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]benzimidazol-1-yl]sulfonyl-phenyl]propionic acid Formula: C27H29N3O8S2 MolecularWeight: 587.66446

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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)OC)CCC(=O)O)C=C(C=C3)OC

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O8S2/c1-16-14-28-22(17(2)26(16)38-5)15-39(33)27-29-21-9-7-19(36-3)13-23(21)30(27)40(34,35)20-8-10-24(37-4)18(12-20)6-11-25(31)32/h7-10,12-14H,6,11,15H2,1-5H3,(H,31,32)