tert-butyl (2S)-6-azanyl-2-[[4-[[(2S)-1-oxidanylidene-3-phenyl-1-phenylmethoxy-propan-2-yl]carbamoyl]-1H-imidazol-5-yl]carbonylamino]hexanoate

Systemtic Name: tert-butyl (2S)-6-azanyl-2-[[4-[[(2S)-1-oxidanylidene-3-phenyl-1-phenylmethoxy-propan-2-yl]carbamoyl]-1H-imidazol-5-yl]carbonylamino]hexanoate Openeye Name: tert-butyl (2S)-6-amino-2-[[4-[[(1S)-1-benzyl-2-benzyloxy-2-oxo-ethyl]carbamoyl]-1H-imidazole-5-carbonyl]amino]hexanoate CAS Name: (2S)-6-amino-2-[[oxo-[4-[oxo-[[(2S)-1-oxo-3-phenyl-1-phenylmethoxypropan-2-yl]amino]methyl]-1H-imidazol-5-yl]methyl]amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-6-amino-2-[[4-[[(2S)-1-oxo-3-phenyl-1-phenylmethoxypropan-2-yl]carbamoyl]-1H-imidazole-5-carbonyl]amino]hexanoate Traditional Name: (2S)-6-amino-2-[[4-[[(1S)-2-benzoxy-1-benzyl-2-keto-ethyl]carbamoyl]-1H-imidazole-5-carbonyl]amino]hexanoic acid tert-butyl ester Formula: C31H39N5O6 MolecularWeight: 577.67126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCCN)NC(=O)C1=C(N=CN1)C(=O)NC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CCCCN)NC(=O)C1=C(N=CN1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C31H39N5O6/c1-31(2,3)42-30(40)23(16-10-11-17-32)35-27(37)25-26(34-20-33-25)28(38)36-24(18-21-12-6-4-7-13-21)29(39)41-19-22-14-8-5-9-15-22/h4-9,12-15,20,23-24H,10-11,16-19,32H2,1-3H3,(H,33,34)(H,35,37)(H,36,38)/t23-,24-/m0/s1