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

Systemtic Name: tert-butyl (2S)-4-methyl-2-[[4-[[(2S)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]carbamoyl]-1H-imidazol-5-yl]carbonylamino]pentanoate Openeye Name: tert-butyl (2S)-2-[[4-[[(1S)-2-benzyloxy-1-methyl-2-oxo-ethyl]carbamoyl]-1H-imidazole-5-carbonyl]amino]-4-methyl-pentanoate CAS Name: (2S)-4-methyl-2-[[oxo-[4-[oxo-[[(2S)-1-oxo-1-phenylmethoxypropan-2-yl]amino]methyl]-1H-imidazol-5-yl]methyl]amino]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-methyl-2-[[4-[[(2S)-1-oxo-1-phenylmethoxypropan-2-yl]carbamoyl]-1H-imidazole-5-carbonyl]amino]pentanoate Traditional Name: (2S)-2-[[4-[[(1S)-2-benzoxy-2-keto-1-methyl-ethyl]carbamoyl]-1H-imidazole-5-carbonyl]amino]-4-methyl-valeric acid tert-butyl ester Formula: C25H34N4O6 MolecularWeight: 486.56066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC(C)(C)C)NC(=O)C1=C(N=CN1)C(=O)NC(C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C25H34N4O6/c1-15(2)12-18(24(33)35-25(4,5)6)29-22(31)20-19(26-14-27-20)21(30)28-16(3)23(32)34-13-17-10-8-7-9-11-17/h7-11,14-16,18H,12-13H2,1-6H3,(H,26,27)(H,28,30)(H,29,31)/t16-,18-/m0/s1