6-[3-phenyl-2-(phenylmethyl)sulfonyl-benzimidazol-5-yl]oxyhexanoic acid

Systemtic Name: 6-[3-phenyl-2-(phenylmethyl)sulfonyl-benzimidazol-5-yl]oxyhexanoic acid Openeye Name: 6-(2-benzylsulfonyl-3-phenyl-benzimidazol-5-yl)oxyhexanoic acid CAS Name: 6-[[3-phenyl-2-(phenylmethyl)sulfonyl-5-benzimidazolyl]oxy]hexanoic acid IUPAC Name: 6-(2-benzylsulfonyl-3-phenylbenzimidazol-5-yl)oxyhexanoic acid Traditional Name: 6-(2-benzylsulfonyl-3-phenyl-benzimidazol-5-yl)oxyhexanoic acid Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C2=NC3=C(N2C4=CC=CC=C4)C=C(C=C3)OCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)C2=NC3=C(N2C4=CC=CC=C4)C=C(C=C3)OCCCCCC(=O)O

InChI

InChI=1S/C26H26N2O5S/c29-25(30)14-8-3-9-17-33-22-15-16-23-24(18-22)28(21-12-6-2-7-13-21)26(27-23)34(31,32)19-20-10-4-1-5-11-20/h1-2,4-7,10-13,15-16,18H,3,8-9,14,17,19H2,(H,29,30)