ethyl 4-[[5-[[(2S)-4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]carbamoyl]-1H-imidazol-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[5-[[(2S)-4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]carbamoyl]-1H-imidazol-4-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[5-[[(1S)-1-benzyloxycarbonyl-3-methyl-butyl]carbamoyl]-1H-imidazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[5-[[[(2S)-4-methyl-1-oxo-1-phenylmethoxypentan-2-yl]amino]-oxomethyl]-1H-imidazol-4-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-[[(2S)-4-methyl-1-oxo-1-phenylmethoxypentan-2-yl]carbamoyl]-1H-imidazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[5-[[(1S)-1-carbobenzoxy-3-methyl-butyl]carbamoyl]-1H-imidazole-4-carbonyl]amino]benzoic acid ethyl ester Formula: C27H30N4O6 MolecularWeight: 506.5503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(NC=N2)C(=O)NC(CC(C)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(NC=N2)C(=O)N[C@@H](CC(C)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H30N4O6/c1-4-36-26(34)19-10-12-20(13-11-19)30-24(32)22-23(29-16-28-22)25(33)31-21(14-17(2)3)27(35)37-15-18-8-6-5-7-9-18/h5-13,16-17,21H,4,14-15H2,1-3H3,(H,28,29)(H,30,32)(H,31,33)/t21-/m0/s1