4-[[3-[[1-(2-methylsulfonylethyl)benzimidazol-2-yl]methyl]-2-oxidanylidene-benzimidazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[3-[[1-(2-methylsulfonylethyl)benzimidazol-2-yl]methyl]-2-oxidanylidene-benzimidazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[3-[[1-(2-methylsulfonylethyl)benzimidazol-2-yl]methyl]-2-oxo-benzimidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[3-[[1-(2-methylsulfonylethyl)-2-benzimidazolyl]methyl]-2-oxo-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 4-[[3-[[1-(2-methylsulfonylethyl)benzimidazol-2-yl]methyl]-2-oxobenzimidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[2-keto-3-[[1-(2-mesylethyl)benzimidazol-2-yl]methyl]benzimidazol-1-yl]methyl]benzoic acid Formula: C26H24N4O5S MolecularWeight: 504.55756

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCN1C2=CC=CC=C2N=C1CN3C4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

CS(=O)(=O)CCN1C2=CC=CC=C2N=C1CN3C4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C26H24N4O5S/c1-36(34,35)15-14-28-21-7-3-2-6-20(21)27-24(28)17-30-23-9-5-4-8-22(23)29(26(30)33)16-18-10-12-19(13-11-18)25(31)32/h2-13H,14-17H2,1H3,(H,31,32)