4-methoxy-3-[5-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfanyl]benzimidazol-1-yl]sulfonyl-benzoic acid

Systemtic Name: 4-methoxy-3-[5-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfanyl]benzimidazol-1-yl]sulfonyl-benzoic acid Openeye Name: 4-methoxy-3-[5-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfanyl]benzimidazol-1-yl]sulfonyl-benzoic acid CAS Name: 4-methoxy-3-[[5-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylthio]-1-benzimidazolyl]sulfonyl]benzoic acid IUPAC Name: 4-methoxy-3-[5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfanyl]benzimidazol-1-yl]sulfonylbenzoic acid Traditional Name: 4-methoxy-3-[5-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylthio]benzimidazol-1-yl]sulfonyl-benzoic acid Formula: C25H25N3O7S2 MolecularWeight: 543.6119

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1OC)C)CSC2=NC3=C(N2S(=O)(=O)C4=C(C=CC(=C4)C(=O)O)OC)C=CC(=C3)OC

Isomeric SMILES

CC1=CN=C(C(=C1OC)C)CSC2=NC3=C(N2S(=O)(=O)C4=C(C=CC(=C4)C(=O)O)OC)C=CC(=C3)OC

InChI

InChI=1S/C25H25N3O7S2/c1-14-12-26-19(15(2)23(14)35-5)13-36-25-27-18-11-17(33-3)7-8-20(18)28(25)37(31,32)22-10-16(24(29)30)6-9-21(22)34-4/h6-12H,13H2,1-5H3,(H,29,30)