2-[cyclohexyl-[[2-(4-phenylmethoxyphenyl)-3H-benzimidazol-5-yl]sulfonyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[cyclohexyl-[[2-(4-phenylmethoxyphenyl)-3H-benzimidazol-5-yl]sulfonyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[2-(4-benzyloxyphenyl)-3H-benzimidazol-5-yl]sulfonyl-cyclohexyl-amino]-2-oxo-acetic acid CAS Name: 2-[cyclohexyl-[[2-(4-phenylmethoxyphenyl)-3H-benzimidazol-5-yl]sulfonyl]amino]-2-oxoacetic acid IUPAC Name: 2-[cyclohexyl-[[2-(4-phenylmethoxyphenyl)-3H-benzimidazol-5-yl]sulfonyl]amino]-2-oxoacetic acid Traditional Name: 2-[[2-(4-benzoxyphenyl)-3H-benzimidazol-5-yl]sulfonyl-cyclohexyl-amino]-2-keto-acetic acid Formula: C28H27N3O6S MolecularWeight: 533.59548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C(=O)C(=O)O)S(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N(C(=O)C(=O)O)S(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H27N3O6S/c32-27(28(33)34)31(21-9-5-2-6-10-21)38(35,36)23-15-16-24-25(17-23)30-26(29-24)20-11-13-22(14-12-20)37-18-19-7-3-1-4-8-19/h1,3-4,7-8,11-17,21H,2,5-6,9-10,18H2,(H,29,30)(H,33,34)