2-[[5-[[1-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]cyclopentyl]carbonylamino]pyridin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[[5-[[1-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]cyclopentyl]carbonylamino]pyridin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[[5-[[1-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]cyclopentanecarbonyl]amino]-2-pyridyl]amino]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[[5-[[[1-[[[1-cyclohexyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]cyclopentyl]-oxomethyl]amino]-2-pyridinyl]amino]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[[5-[[1-[[1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]cyclopentanecarbonyl]amino]pyridin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[[5-[[1-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]cyclopentanecarbonyl]amino]-2-pyridyl]amino]-4-methyl-thiazole-5-carboxylic acid Formula: C34H35N7O5S MolecularWeight: 653.7506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=NC=C(C=C2)NC(=O)C3(CCCC3)NC(=O)C4=CC5=C(C=C4)N(C(=N5)C6=COC=C6)C7CCCCC7)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)NC2=NC=C(C=C2)NC(=O)C3(CCCC3)NC(=O)C4=CC5=C(C=C4)N(C(=N5)C6=COC=C6)C7CCCCC7)C(=O)O

InChI

InChI=1S/C34H35N7O5S/c1-20-28(31(43)44)47-33(36-20)39-27-12-10-23(18-35-27)37-32(45)34(14-5-6-15-34)40-30(42)21-9-11-26-25(17-21)38-29(22-13-16-46-19-22)41(26)24-7-3-2-4-8-24/h9-13,16-19,24H,2-8,14-15H2,1H3,(H,37,45)(H,40,42)(H,43,44)(H,35,36,39)