6-azanyl-2-[[1-cyclohexyl-2-(2-phenylquinolin-6-yl)benzimidazol-5-yl]carbonylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[1-cyclohexyl-2-(2-phenylquinolin-6-yl)benzimidazol-5-yl]carbonylamino]hexanoic acid Openeye Name: 6-amino-2-[[1-cyclohexyl-2-(2-phenyl-6-quinolyl)benzimidazole-5-carbonyl]amino]hexanoic acid CAS Name: 6-amino-2-[[[1-cyclohexyl-2-(2-phenyl-6-quinolinyl)-5-benzimidazolyl]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[[1-cyclohexyl-2-(2-phenylquinolin-6-yl)benzimidazole-5-carbonyl]amino]hexanoic acid Traditional Name: 6-amino-2-[[1-cyclohexyl-2-(2-phenyl-6-quinolyl)benzimidazole-5-carbonyl]amino]hexanoic acid Formula: C35H37N5O3 MolecularWeight: 575.69998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC(CCCCN)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC(CCCCN)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H37N5O3/c36-20-8-7-13-30(35(42)43)39-34(41)26-16-19-32-31(22-26)38-33(40(32)27-11-5-2-6-12-27)25-15-18-29-24(21-25)14-17-28(37-29)23-9-3-1-4-10-23/h1,3-4,9-10,14-19,21-22,27,30H,2,5-8,11-13,20,36H2,(H,39,41)(H,42,43)