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

Systemtic Name: 2-[6-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonylbenzenesulfonic acid Openeye Name: 2-[6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]benzimidazol-1-yl]sulfonylbenzenesulfonic acid CAS Name: 2-[[6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-1-benzimidazolyl]sulfonyl]benzenesulfonic acid IUPAC Name: 2-[6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonylbenzenesulfonic acid Traditional Name: 2-[6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]benzimidazol-1-yl]sulfonylbesylic acid Formula: C23H23N3O8S3 MolecularWeight: 565.63902

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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=C4S(=O)(=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=CC=C4S(=O)(=O)O)C=C(C=C3)OC

InChI

InChI=1S/C23H23N3O8S3/c1-14-12-24-18(15(2)22(14)34-4)13-35(27)23-25-17-10-9-16(33-3)11-19(17)26(23)36(28,29)20-7-5-6-8-21(20)37(30,31)32/h5-12H,13H2,1-4H3,(H,30,31,32)