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

Systemtic Name: (phenylmethyl) (2S)-4-methyl-2-[[5-[(phenylmethyl)carbamoyl]-1H-imidazol-4-yl]carbonylamino]pentanoate Openeye Name: benzyl (2S)-2-[[5-(benzylcarbamoyl)-1H-imidazole-4-carbonyl]amino]-4-methyl-pentanoate CAS Name: (2S)-4-methyl-2-[[oxo-[5-[oxo-[(phenylmethyl)amino]methyl]-1H-imidazol-4-yl]methyl]amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[5-(benzylcarbamoyl)-1H-imidazole-4-carbonyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[5-(benzylcarbamoyl)-1H-imidazole-4-carbonyl]amino]-4-methyl-valeric acid benzyl ester Formula: C25H28N4O4 MolecularWeight: 448.51422

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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)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)C[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)C2=C(NC=N2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H28N4O4/c1-17(2)13-20(25(32)33-15-19-11-7-4-8-12-19)29-24(31)22-21(27-16-28-22)23(30)26-14-18-9-5-3-6-10-18/h3-12,16-17,20H,13-15H2,1-2H3,(H,26,30)(H,27,28)(H,29,31)/t20-/m0/s1