3-(4-benzamidophenyl)-2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]propanoic acid

Systemtic Name: 3-(4-benzamidophenyl)-2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]propanoic acid Openeye Name: 3-(4-benzamidophenyl)-2-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]propanoic acid CAS Name: 3-(4-benzamidophenyl)-2-[[[1-cyclohexyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-benzamidophenyl)-2-[[1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]propanoic acid Traditional Name: 3-(4-benzamidophenyl)-2-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]propionic acid Formula: C34H32N4O5 MolecularWeight: 576.64168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC(CC4=CC=C(C=C4)NC(=O)C5=CC=CC=C5)C(=O)O)N=C2C6=COC=C6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC(CC4=CC=C(C=C4)NC(=O)C5=CC=CC=C5)C(=O)O)N=C2C6=COC=C6

InChI

InChI=1S/C34H32N4O5/c39-32(23-7-3-1-4-8-23)35-26-14-11-22(12-15-26)19-29(34(41)42)37-33(40)24-13-16-30-28(20-24)36-31(25-17-18-43-21-25)38(30)27-9-5-2-6-10-27/h1,3-4,7-8,11-18,20-21,27,29H,2,5-6,9-10,19H2,(H,35,39)(H,37,40)(H,41,42)