tert-butyl 4-[[4-[[(2S)-4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]carbamoyl]-1H-imidazol-5-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-[[(2S)-4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]carbamoyl]-1H-imidazol-5-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-[[(1S)-1-benzyloxycarbonyl-3-methyl-butyl]carbamoyl]-1H-imidazole-5-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[4-[[[(2S)-4-methyl-1-oxo-1-phenylmethoxypentan-2-yl]amino]-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-[[(2S)-4-methyl-1-oxo-1-phenylmethoxypentan-2-yl]carbamoyl]-1H-imidazole-5-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-[[(1S)-1-carbobenzoxy-3-methyl-butyl]carbamoyl]-1H-imidazole-5-carbonyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H39N5O6 MolecularWeight: 541.63916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(=O)C2=C(NC=N2)C(=O)NC3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)C2=C(NC=N2)C(=O)NC3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C28H39N5O6/c1-18(2)15-21(26(36)38-16-19-9-7-6-8-10-19)32-25(35)23-22(29-17-30-23)24(34)31-20-11-13-33(14-12-20)27(37)39-28(3,4)5/h6-10,17-18,20-21H,11-16H2,1-5H3,(H,29,30)(H,31,34)(H,32,35)/t21-/m0/s1