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

Systemtic Name: tert-butyl (2S)-4-methyl-2-[[4-[[(1S)-1-phenylethyl]carbamoyl]-1H-imidazol-5-yl]carbonylamino]pentanoate Openeye Name: tert-butyl (2S)-4-methyl-2-[[4-[[(1S)-1-phenylethyl]carbamoyl]-1H-imidazole-5-carbonyl]amino]pentanoate CAS Name: (2S)-4-methyl-2-[[oxo-[4-[oxo-[[(1S)-1-phenylethyl]amino]methyl]-1H-imidazol-5-yl]methyl]amino]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-methyl-2-[[4-[[(1S)-1-phenylethyl]carbamoyl]-1H-imidazole-5-carbonyl]amino]pentanoate Traditional Name: (2S)-4-methyl-2-[[4-[[(1S)-1-phenylethyl]carbamoyl]-1H-imidazole-5-carbonyl]amino]valeric acid tert-butyl ester Formula: C23H32N4O4 MolecularWeight: 428.52458

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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)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C1=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/C23H32N4O4/c1-14(2)12-17(22(30)31-23(4,5)6)27-21(29)19-18(24-13-25-19)20(28)26-15(3)16-10-8-7-9-11-16/h7-11,13-15,17H,12H2,1-6H3,(H,24,25)(H,26,28)(H,27,29)/t15-,17-/m0/s1