3-[[3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]cyclohexyl]carbamoylamino]benzoic acid

Systemtic Name: 3-[[3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]cyclohexyl]carbamoylamino]benzoic acid Openeye Name: 3-[[3-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]cyclohexyl]carbamoylamino]benzoic acid CAS Name: 3-[[[[3-[[[1-cyclohexyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]cyclohexyl]amino]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]cyclohexyl]carbamoylamino]benzoic acid Traditional Name: 3-[[3-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]cyclohexyl]carbamoylamino]benzoic acid Formula: C32H35N5O5 MolecularWeight: 569.6508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC4CCCC(C4)NC(=O)NC5=CC=CC(=C5)C(=O)O)N=C2C6=COC=C6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC4CCCC(C4)NC(=O)NC5=CC=CC(=C5)C(=O)O)N=C2C6=COC=C6

InChI

InChI=1S/C32H35N5O5/c38-30(33-24-8-5-9-25(18-24)35-32(41)34-23-7-4-6-21(16-23)31(39)40)20-12-13-28-27(17-20)36-29(22-14-15-42-19-22)37(28)26-10-2-1-3-11-26/h4,6-7,12-17,19,24-26H,1-3,5,8-11,18H2,(H,33,38)(H,39,40)(H2,34,35,41)