5-[[4-[[1-cyclohexyl-2-(furan-2-yl)benzimidazol-5-yl]carbonylamino]piperidin-4-yl]carbonylamino]-1-methyl-indole-2-carboxylic acid

Systemtic Name: 5-[[4-[[1-cyclohexyl-2-(furan-2-yl)benzimidazol-5-yl]carbonylamino]piperidin-4-yl]carbonylamino]-1-methyl-indole-2-carboxylic acid Openeye Name: 5-[[4-[[1-cyclohexyl-2-(2-furyl)benzimidazole-5-carbonyl]amino]piperidine-4-carbonyl]amino]-1-methyl-indole-2-carboxylic acid CAS Name: 5-[[[4-[[[1-cyclohexyl-2-(2-furanyl)-5-benzimidazolyl]-oxomethyl]amino]-4-piperidinyl]-oxomethyl]amino]-1-methyl-2-indolecarboxylic acid IUPAC Name: 5-[[4-[[1-cyclohexyl-2-(furan-2-yl)benzimidazole-5-carbonyl]amino]piperidine-4-carbonyl]amino]-1-methylindole-2-carboxylic acid Traditional Name: 5-[[4-[[1-cyclohexyl-2-(2-furyl)benzimidazole-5-carbonyl]amino]isonipecotoyl]amino]-1-methyl-indole-2-carboxylic acid Formula: C34H36N6O5 MolecularWeight: 608.68684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)C3(CCNCC3)NC(=O)C4=CC5=C(C=C4)N(C(=N5)C6=CC=CO6)C7CCCCC7)C=C1C(=O)O

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)C3(CCNCC3)NC(=O)C4=CC5=C(C=C4)N(C(=N5)C6=CC=CO6)C7CCCCC7)C=C1C(=O)O

InChI

InChI=1S/C34H36N6O5/c1-39-26-12-10-23(18-22(26)20-28(39)32(42)43)36-33(44)34(13-15-35-16-14-34)38-31(41)21-9-11-27-25(19-21)37-30(29-8-5-17-45-29)40(27)24-6-3-2-4-7-24/h5,8-12,17-20,24,35H,2-4,6-7,13-16H2,1H3,(H,36,44)(H,38,41)(H,42,43)