5-cyclohexyl-4-[2-[(2-methylpropan-2-yl)oxycarbonyl-pyrazol-1-yl-amino]propanoylamino]-3-oxidanyl-pentanoic acid

Systemtic Name: 5-cyclohexyl-4-[2-[(2-methylpropan-2-yl)oxycarbonyl-pyrazol-1-yl-amino]propanoylamino]-3-oxidanyl-pentanoic acid Openeye Name: 4-[2-[tert-butoxycarbonyl(pyrazol-1-yl)amino]propanoylamino]-5-cyclohexyl-3-hydroxy-pentanoic acid CAS Name: 5-cyclohexyl-3-hydroxy-4-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(1-pyrazolyl)amino]-1-oxopropyl]amino]pentanoic acid IUPAC Name: 5-cyclohexyl-3-hydroxy-4-[2-[(2-methylpropan-2-yl)oxycarbonyl-pyrazol-1-ylamino]propanoylamino]pentanoic acid Traditional Name: 4-[2-[tert-butoxycarbonyl(pyrazol-1-yl)amino]propanoylamino]-5-cyclohexyl-3-hydroxy-valeric acid Formula: C22H36N4O6 MolecularWeight: 452.54444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1CCCCC1)C(CC(=O)O)O)N(C(=O)OC(C)(C)C)N2C=CC=N2

Isomeric SMILES

CC(C(=O)NC(CC1CCCCC1)C(CC(=O)O)O)N(C(=O)OC(C)(C)C)N2C=CC=N2

InChI

InChI=1S/C22H36N4O6/c1-15(26(25-12-8-11-23-25)21(31)32-22(2,3)4)20(30)24-17(18(27)14-19(28)29)13-16-9-6-5-7-10-16/h8,11-12,15-18,27H,5-7,9-10,13-14H2,1-4H3,(H,24,30)(H,28,29)